BOR

(1R)-1-AMINO-4-{[(E)-AMINO(IMINO)METHYL]AMINO}BUTYLBORONIC ACID

Created:	2003-03-24
Last modified:	2024-09-27

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2 entries where BOR is found in a polymer sequence

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Chemical Details
Formal Charge	0
Atom Count	27
Chiral Atom Count	1
Bond Count	26
Aromatic Bond Count	0

2D diagram of BOR

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Chemical Component Summary
Name	(1R)-1-AMINO-4-{[(E)-AMINO(IMINO)METHYL]AMINO}BUTYLBORONIC ACID
Synonyms	BORO ARGININE
Systematic Name (OpenEye OEToolkits)	[(1R)-1-azanyl-4-carbamimidamido-butyl]boronic acid
Formula	C₅ H₁₅ B N₄ O₂
Molecular Weight	174.009
Type	PEPTIDE-LIKE

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	OB(O)C(N)CCCNC(=[N@H])N
SMILES	CACTVS	3.370	N[CH](CCCNC(N)=N)B(O)O
SMILES	OpenEye OEToolkits	1.7.0	B(C(CCCNC(=N)N)N)(O)O
Canonical SMILES	CACTVS	3.370	N[C@@H](CCCNC(N)=N)B(O)O
Canonical SMILES	OpenEye OEToolkits	1.7.0	B([C@H](CCCNC(=N)N)N)(O)O
InChI	InChI	1.03	InChI=1S/C5H15BN4O2/c7-4(6(11)12)2-1-3-10-5(8)9/h4,11-12H,1-3,7H2,(H4,8,9,10)/t4-/m0/s1
InChIKey	InChI	1.03	ACTXPNAHMKBUTO-BYPYZUCNSA-N

Related Resource References

Resource Name	Reference
PubChem	10219633
ChEMBL	CHEMBL1231428

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