GVM

(3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACID

Created:	2007-03-15
Last modified:	2011-06-04

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1 entries where GVM is found as a standalone ligand

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

2D diagram of GVM

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Chemical Component Summary
Name	(3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACID
Systematic Name (OpenEye OEToolkits)	(3R)-3-hydroxy-5,5-dimethyl-hexanoic acid
Formula	C₈ H₁₆ O₃
Molecular Weight	160.211
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(O)CC(O)CC(C)(C)C
SMILES	CACTVS	3.341	CC(C)(C)C[CH](O)CC(O)=O
SMILES	OpenEye OEToolkits	1.5.0	CC(C)(C)CC(CC(=O)O)O
Canonical SMILES	CACTVS	3.341	CC(C)(C)C[C@@H](O)CC(O)=O
Canonical SMILES	OpenEye OEToolkits	1.5.0	CC(C)(C)C[C@H](CC(=O)O)O
InChI	InChI	1.03	InChI=1S/C8H16O3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3,(H,10,11)/t6-/m0/s1
InChIKey	InChI	1.03	PHACRADGRHURFF-LURJTMIESA-N

Related Resource References

Resource Name	Reference
PubChem	14545622
ChEMBL	CHEMBL1160887

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