4DY

(6E)-N-(4-hydroxy-3-methoxybenzyl)-8-methylnon-6-enamide

Created:	2015-04-30
Last modified:	2020-05-26

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7 entries where 4DY is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	49
Chiral Atom Count	0
Bond Count	49
Aromatic Bond Count	6

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Chemical Component Summary
Name	(6E)-N-(4-hydroxy-3-methoxybenzyl)-8-methylnon-6-enamide
Synonyms	Capsaicin; 8-Methyl-N-vanillyl-trans-6-nonenamide; NGX-4010
Systematic Name (OpenEye OEToolkits)	(E)-N-[(3-methoxy-4-oxidanyl-phenyl)methyl]-8-methyl-non-6-enamide
Formula	C₁₈ H₂₇ N O₃
Molecular Weight	305.412
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1(CNC(CCCC[C@H]=CC(C)C)=O)cc(OC)c(cc1)O
SMILES	CACTVS	3.385	COc1cc(CNC(=O)CCCCC=CC(C)C)ccc1O
SMILES	OpenEye OEToolkits	1.7.6	CC(C)C=CCCCCC(=O)NCc1ccc(c(c1)OC)O
Canonical SMILES	CACTVS	3.385	COc1cc(CNC(=O)CCCC/C=C/C(C)C)ccc1O
Canonical SMILES	OpenEye OEToolkits	1.7.6	CC(C)/C=C/CCCCC(=O)NCc1ccc(c(c1)OC)O
InChI	InChI	1.03	InChI=1S/C18H27NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h6,8,10-12,14,20H,4-5,7,9,13H2,1-3H3,(H,19,21)/b8-6+
InChIKey	InChI	1.03	YKPUWZUDDOIDPM-SOFGYWHQSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License

DrugBank ID	DB06774
Name	Capsaicin
Groups	approved investigational
Description	Capsaicin is most often used as a topical analgesic and exists in many formulations of cream, liquid, and patch preparations of various strengths; however, it may also be found in some dietary supplements. Capsaicin is a naturally-occurring botanical irritant in chili peppers, synthetically derived for pharmaceutical formulations. The most recent capsaicin FDA approval was Qutenza, an 8% capsaicin patch dermal-delivery system, indicated for neuropathic pain associated with post-herpetic neuralgia.
Synonyms	trans-8-Methyl-N-vanillyl-6-nonenamide Isodecenoic acid vanillylamide Capsaicin Capsaicina (E)-8-Methyl-N-vanillyl-6-nonenamide
Brand Names	Pain Relieving Medi-sulting Topical Pain Relief Awaye Penetrex(r) Arthritis Pain Relief Coralite Topical Analgesic Capsaicin Heat NuDiclo SoluPak CANNABIN PLUS Warming Pain Relief Nexalgia Arthritis Extra Strength Roll-ON Lotion Sherman and Clark Pain Relieving K2c Eagle Oprava MINTED LEAF Heat Therapy Roll-On with Capsaicin and CBD Arthricare for Women Extra Moisturizing Pain Relief Roll On Revlex Arthritis Pain Relief Kool Heat Pain Therapy PainKoolers Topical Analgesic Patch Family Care Arthritis Pain Relief Anodynz Biofrequency Chip Hong Hoa Pain Relieving Sinelee Menthol, Capsaicin Capsaicin NuDroxiPAK M-15 LidoPro Ameri Patch Arthritazin Pain Relieving VANTELIN HOT PAIN RELIEVING Gel Patch LaBella Linimento Obrero Extra Strength Pain Reliever Sure Result DSS Premium Pak Terphouse Rock Sauce Terocin Capzix Cannavera Pain Relief Diclosiacin Parche Leon Milagroso Capsaicin No-Fuss Applicator NuDroxicin pain relief Roll-On DCH Arthritis Pain Relief Roll-On N-LABS SOLAR MAX Topical Analgesic Hot spot point relief Arthricare for Women Quick Drying VitaCin Rotex Capsaicin Mild Cream Flanax Liniment Flanax Liniment Unit Dose Display Offense Player Arthritis Pain Adazin Born Again Super Pain Relieving Lotion Pain Relief Patch CVS Capsaicin arthritis pain relief Compression Sock Astrapharm Chilli Brand NuDroxicin Zostrix Joint and Arthritis Pain Relief SmartRx Gaba-V Kit Zostrix High Potency Foot Pain Relief Pure Relief Nufabrx Lower Leg Sleeve XS/S PainKoolers Topical Analgesic Med O-3 Bio- Nufabrx Lower Leg Sleeve Nufabrx Ankle Sock Alivio Equi-block Dt Formula NaproPax Zang Hong Hua Pain Relieving Rematex Theragen Diclosaicin Genorthix Pain Relieving Roll On Exoten-C Dyninex Antiphlogistine Rub A-535 Capsaicin Liquid Flexin CareOne Arthritis Pain Relief Rocksauce Fire Capsicum Patch Atomic Balm Inavix Sure Relief SR Relief Hot Pain Relief CVS Medicated Heat 1 ct Better Nature Pain Relief BalmX Benejoint Nufabrx Lower Leg Sleeve M/L Aflexeryl-MC Nuvira Topical Pain Relief Rx Miracle Plus Neck and Shoulder Pain Relief Ageranium Patch Overtime-HMP Castiva Warming Doloracin Rx Arthritic Pain Relief Zostrix Foot Pain Relief Relyyt Australian Dream Power 4 Muscle and Joint Pain Relief Cream Capxib Capzasin Quick Relief Nufabrx Arm Sleeve Zostrix Original Strength Capsaicin Cream 0.025% Toplast Cool and Hot Menthol 1.25percent plus Capsaicin 0.025percent MedWorx Triple Action Arthritis Aspercreme Warming Patch Medi-derm Rx Joint Maintenance Compliance Kit Xoten-C Menthocin Patch with Lidocaine - Strong NuDroxiPAK N-500 Solstice Capsaicin Patch Hot Dr. Harveys Herbal Motion Pain Formula BioMega Heat Pain Therapy Glacierix Chill Pain Away NuDroxiPAK E-400 Omega 3 Transderm-iQ Medi-patch With Lidocaine Megrix Meijer Capsaicin Yunnan Baiyao Arthritis Pain Relief Overtime-X Capzasin No Mess Applicator Menthozen Hydrogel Patch Flex-OL Remaxazon External Patch Tianhe Gutong Tiegao (in Polyisobutylene Carrier) Medrox-Rx Dr.'s Cream Leader Capsaicin Wellness Products J-FLEX Ultra Strength Pain Relief MINTED LEAF Heat Therapy Relief Roll On Raging Kakapo Pain Relieve Capzasin HP Arthritis Pain Relief Pain Relief Cream Extra Strength Muscular Balm Ziclopro Apanol Linimento Obrero Qroxin Patch Reliever Migryl Biofrequency Chip Coralite Pain Relief Hot Kapsin External Analgesic Transderm-IQ Good Neighbor Pharmacy Capsaicin Coralite Muscle and Joint Pain Relief Capsimide Fast Arthritis Aid Pain Relieving Flanax MediRelief Hot Gellert Joint Care PainMD Max 1st Medxpatch With Lidocaine 4% Kentwool SensationWool with Nufabrx Rugby Arthritis Pain Relieving Topical Analgesic Trans-D Walgreens Capsaicin Hot HURT BLOCKER PRO Pain Relief Nuvira Patch Arthritazin Pain Relieving EZ Bio-Sorb Therapy Pain Satogesic Hot Medi-derm Topical Pain Relief Nufabrx Medicine Infused Ankle Sleeve AVON HeXashield Arthritis Pain Relief Cream Capsaisin Pain Away Preferred Plus Arthritis Cream Nufabrx Diabetic Sock Corisin Arthritis Pain Relief Cvs Capsaicin PainBloc NobleAid CapsAid Zostrix Diabetic Joint and Arthritis Pain Relief Ziclocin Releevia MC Aspercreme Warming Fatazen Sweat Enhance Hot FYZICAL SPORTS Pain Relief 2 MILD BIO-MEGA Heat Therapy Zostrix Foot Pain Relief Maximum Strength Dendracin Neurodendraxcin BRONSON SOOTHE Pain Relief Medi-patch With Lidocaine Rx Alegenix Biofrequency Chip Capzasin-P Creme - 0.025% LexiCaps Blue Ice Pain Relieving IRxAmigra 2-Count HEAT PATCHES NuDroxiPAK Littles All Natural Arthritic Pain Relief Good Neighbor Pharmacy Arthritis Pain Relief CapsFenac Pak Assured Pain Relief Hot Patch MaC Patch Satohap Cool and Hot Pads Dolor-parche With Lidocaine-RX PureKana Medicated Heat Reme D Zostrix Hot and Cold Therapy System Toplast Hot Capsaicin 0.025percent Capsaicin Heat Patches Pain Relief Neuriterx Diclofex DC Kapsin Wellness Products VictoRx Nopiate Topical Pain Relief QC Arthritis Pain Relief Douleurin Topical Pain Relief Mendex Capsaicin 0.1 Percent Therapatch Warm Minted Leaf Heat Therapy Relief Roll-On Xyphex Biofrequency Chip Alivio Medicated Pain Frankie Avalons ZERO PAIN Original Formula Roll-On Maximum Strength PAIN RELIEVER Bioaches Menthol 4.5% Capsaicin 0.0225% NuDroxiPAK DSDR-75 Painazin CP Pain Relieving Roll-On Capsaicin Regular Cream Dr Iyers MyoRub DicloHeal-60 Dfs 1.5%/ms 25%/menth 6%/cap 0.025% Pak Complete hemp Fesi Kanjo Natural Pain relief oil Aspercreme Warming No Mess Diclovix CM Ziks Arthritis Pain Relief Doloracin/l Rx With Lidocaine Antiphlogistine Rub A-535 Capsaicin Gel Overtime LABOFLEX Cool and Hot Menthol 1.25 percent Capsaicin 0.025 percent Toplast Cool and Hot Menthol 5percent plus Capsaicin 0.025percent Hot Spot Point Relief Coralite Pain Relief 0.025% Capsaicin Pain relief Patch Astrapharm Chilli Brand External Medicated DFS 75mg DR/MS 25%/MENTH 6%/CAP 0.025% PAK Screamin Hot Toast Mac Family Care Thera Flex Pain LONOL Forte Gel Zostrix Hp LCDO. ORLANDO RIVERA ARTHRITIS Topical Analgesic NaproxenPax Solaice ZENSEZONE Arthmed Temporary Pain Relief Cream FYZICAL SPORTS Pain Relief 1-COOL LaboFlex Cool and Hot Menthol 1.25 percent Capsaicin 0.025 percent Sinsinpas Hot Large Lido-RX 4.1 Menthozen Cream Capsinac Migryl WellPatch Capsaicin Pain Relief NuDroxiPAK I-800 Capsaicin Arthritis Pain Relief Cream Reliaderm Pallerix OTC BIOfrequency Chip VANTELIN HOT PAIN RELIEVING Gel Patch Large Capsaicin Pain Relief CVS Capsaicin Iclofenac CP Moor Balm - Crm Pain Relieving Gel-Patch Nufabrx Back Wrap Weh-Weh Natural Pain relief oil 1st Medxpatch With Lidocaine 4%-rx Synovium Pain Relieving Gel Neurodexx Medi-derm / L With Lidocaine Rx Hot Pain Relieving Pennsaicin Arthritis Pain Reliever Capsaicin Hot Patches Campo pharma Muscle hot Capsodan Cream Ultimate Topical Pain Relief Patch Aleveer Patch Capsaicin Heat Patches Back and Large Areas Walgreens Arthritis Pain Relief Capsaicin Analgesic Capsiderm DICLAREAL TOPICAL kit Rugby Capsaicin External Analgesic Nufabrx Calf Sleeve Menthozen Pain Relief Menthocin Patch with Lidocaine Allevess BLUE SPRING Foot and Leg Comfort Cream with Pain Relief Lidopro Kapzin DC Miracle Plus Overnight Pain Relieving MenCaps Rocksauce Ice True Pain Relief Plus CopperFixx Levatio Patch Power Pain Relief Stick Menthozen Hydrogel Medi-derm / L With Lidocaine Sinsinpas Hot Soothanol X2 Captracin Equate Capsaicin Pain Relieving Limencin Rezil FlexxSonic Pain Relief beeRX Muscle and Joint Pain Relief Megrix OTC External Analgesic Rite Aid Capsicum Hot Kerasal NeuroCream Neuvaxin Patch Nufabrx Hand/Wrist Sleeve CyclobenzaprinePax Frankie Avalons Zero Pain Roll On Leader Capsaicin Pain Relief Cream bB Medicated Pain Relieving Oil Tianhe Zhuifeng Gao Neuriterx 0.05% Nufabrx Grey Polka Dot Sock Ultracin Nufabrx Foot/Ankle Sleeve Capsaicin Topical Analgesic Wasabi Rub Renovo BioMega Tianhe Gutong Tiegao Medicated Compression Sock My Omega Heat Therapy Red Hot Arth Arrest Fors Pain Relief CVS Roll-On Flexipak Better Nature Pain Relief Cream Menthacin Lotion NuDroxiPAK DSDR-50 Simanix PainKoolers Sure Result SR Relief Paraid Hot Capsicum DINGTAI PHARMATopical Analgesic Ultra Therapy Pain Relief Menthacin - Cream InstaSoothe Pain Relief Capsaicin 0.075 Percent Hurt Blocker Pro Nufabrx Wrist Sleeve Trubrexa Transanosil Capment Earths Care Arthritis Capsaicin HP Arthritis Pain Relief Nufabrx Medicine Infused Socks Capsaicin Heat NuDiclo TabPak Releevia Arth RX Topical Analgesic Outdoor Hands Pure Pain Relief Trubrexa Patch ER Nufabrx Compression Sock Nufabrx Knee Sleeve RETADOLOR Pain Relief Qutenza Diclopak Melt Pain Away Neuritrx Pure Relief Penetrating Pain Relief Emu Essentials Brand Pain Relieving Medicated Pain Relief Hot Capsaicin Forte Cream Topical Pain Relief Dr Demand Relief Pain Relief 3% Menthol plus 0.083% Capsaicin Pain Relief Patch FYZICAL SPORTS Pain Relief LBri Super Aloe Stop The Pain Coralite Medicated Heat Dr. OH BALM CareALL Arthritis and Muscle Anodynz KASEHA Pain Relieving Gel Perform Atomic Heat SumaChip WellPatch Warming Pain Relief Pain Relief Hot Patch Capsaicin Cream RockSauce FIERY HOT PAIN RELIEF Arthritis Pain Relief Nufabrx Lower Leg Sleeve XL/XXL Renovo Lido5 Silvera Pain Relief Patch PainBloc24 Theragen HP Jupiter Pain Patch Arthmed Topical Analgesic Red hot Capzasin P Arthritis Pain Relief Omega 3 Heat Therapy AthletesGel Parche Leon Mega Patch Heet Liniment Liq Toplast Cool and Hot Menthol 4percent plus Capsaicin 0.025percent CMC Pain Relieving Rugby Capsaicin Cream Nufabrx Ankle Sleeve A2a Arthritis Guardania Pain Arthricare for Women Multi-action FourPainRX AmeriPatch Cajun Hot Ice Muscle and Joint Pain Rub Pallerix Mentholatum Ironman Dusel Warm Arthritis Dead Sea Salt Therapy Invisible Pain Arthur Itis Cream AnodyneRx Parche Leon Milagroso Dual Action IRxMyoRub New Terocin SprayPain Away Kessler Family Wellness EMU THERAPY Red Hot Pepper Pain Relief Cream Overtime-hmp LivRelief Pain Relief Offense Player Sports Moisturizing Glucosamine Brand Astronic CMX Topical Pain FlexePax Nufabrx Neck Wrap Rub A535 Capsaicin Soothee Patch Soothe Capsaicin External Analgesic Good Neighbor Capsaicin Heat Patch for Back Assured Pain Relief Hot Menthol Hempvana Ultra Strength Pain Relief Cream - Deep Heat Medrox
Indication	The capsaicin 8% patch is indicated in the treatment of neuropathic pain associated with post-herpetic neuralgia. There are multiple topical capsaicin formulations available, including creams and solutions, indicated for temporary analgesia in muscle and join pain as well as neuropathic pain.
Categories	Alkaloids Alkenes Amides Analgesics Anesthetics Anesthetics, Local Antipruritics Basic Lotions and Liniments Benzene Derivatives Capsaicin and Similar Agents Cholinesterase Inhibitors Cytochrome P-450 CYP1A2 Inducers Cytochrome P-450 CYP1A2 Inducers (strength unknown) Cytochrome P-450 CYP1A2 Substrates Cytochrome P-450 CYP2E1 Substrates Cytochrome P-450 CYP3A Inhibitors Cytochrome P-450 CYP3A4 Inhibitors Cytochrome P-450 CYP3A4 Inhibitors (strength unknown) Cytochrome P-450 Enzyme Inducers Cytochrome P-450 Enzyme Inhibitors Cytochrome P-450 Substrates Dermatologicals Lipids Monoamine Oxidase A Inhibitors for interaction with Monoamine Oxidase A substrates Peripheral Nervous System Agents Phenols Polyunsaturated Alkamides Sensory System Agents Solanaceous Alkaloids Topical Products for Joint and Muscular Pain TRPV1 Channel Agonists
ATC-Code	M02AB01 N01BX04
CAS number	404-86-4

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License

Name	Target Sequence	Pharmacological Action	Actions
Transient receptor potential cation channel subfamily V member 1	MKKWSSTDLGAAADPLQKDTCPDPLDGDPNSRPPPAKPQLSTAKSRTRLF...	unknown	agonist,regulator
Prohibitin-2	MAQNLKDLAGRLPAGPRGMGTALKLLLGAGAVAYGVRESVFTVEGGHRAI...	unknown	modulator
Cytochrome P450 3A4	MALIPDLAMETWLLLAVSLVLLYLYGTHSHGLFKKLGIPGPTPLPFLGNI...	unknown	inhibitor
Prostaglandin G/H synthase 2	MLARALLLCAVLALSHTANPCCSHPCQNRGVCMSVGFDQYKCDCTRTGFY...	unknown	inhibitor
Myeloperoxidase	MGVPFFSSLRCMVDLGPCWAGGLTAEMKLLLALAGLLAILATPQPSEGAA...	unknown	inhibitor
Cytochrome P450 1A2	MALSQSVPFSATELLLASAIFCLVFWVLKGLRPRVPKGLKSPPEPWGWPL...	unknown	substrate,inducer
Cytochrome P450 2E1	MSALGVTVALLVWAAFLLLVSMWRQVHSSWNLPPGPFPLPIIGNLFQLEL...	unknown	substrate
Amine oxidase [flavin-containing] A	MENQEKASIAGHMFDVVVIGGGISGLSAAKLLTEYGVSVLVLEARDRVGG...	unknown	inhibitor
Dopamine beta-hydroxylase	MPALSRWASLPGPSMREAAFMYSTAVAIFLVILVAALQGSAPRESPLPYH...	unknown	inhibitor
Glutamine synthetase	MTTSASSHLNKGIKQVYMSLPQGEKVQAMYIWIDGTGEGLRCKTRTLDSE...	unknown	inducer
Cholinesterase	MHSKVTIICIRFLFWFLLLCMLIGKSHTEDDIIIATKNGKVRGMNLTVFG...	unknown	inhibitor
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Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682