FQZ

(1~{R},3~{S},4~{R},5~{R})-3-methyl-4,5-bis(hydroxyl)cyclohexane-1-carboxylic acid

Created:	2018-07-25
Last modified:	2024-09-27

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Chemical Details
Formal Charge	0
Atom Count	26
Chiral Atom Count	4
Bond Count	26
Aromatic Bond Count	0

2D diagram of FQZ

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Chemical Component Summary
Name	(1~{R},3~{S},4~{R},5~{R})-3-methyl-4,5-bis(hydroxyl)cyclohexane-1-carboxylic acid
Systematic Name (OpenEye OEToolkits)	(1~{R},3~{S},4~{R},5~{R})-3-methyl-4,5-bis(oxidanyl)cyclohexane-1-carboxylic acid
Formula	C₈ H₁₄ O₄
Molecular Weight	174.194
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	C[CH]1C[CH](C[CH](O)[CH]1O)C(O)=O
SMILES	OpenEye OEToolkits	2.0.6	CC1CC(CC(C1O)O)C(=O)O
Canonical SMILES	CACTVS	3.385	C[C@H]1C[C@H](C[C@@H](O)[C@@H]1O)C(O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.6	C[C@H]1C[C@H](C[C@H]([C@@H]1O)O)C(=O)O
InChI	InChI	1.03	InChI=1S/C8H14O4/c1-4-2-5(8(11)12)3-6(9)7(4)10/h4-7,9-10H,2-3H2,1H3,(H,11,12)/t4-,5+,6+,7+/m0/s1
InChIKey	InChI	1.03	OBDLOCPYNMEWCH-BDVNFPICSA-N

Related Resource References

Resource Name	Reference
PubChem	138857400

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