AB42739
79902-63-9 | (1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate
Manufacturer: A2B Chem
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CatalogNumber
AB42739
ChemicalName
(1S,3R,7S,8S,8aR)-8-{2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl}-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate
CasNumber
79902-63-9
MolecularFormula
C25H38O5
MolecularWeight
418.5662
MdlNumber
MFCD00072007
Smiles
CCC(C(=O)OC1CC(C)C=C2C1C(CCC1CC(O)CC(=O)O1)C(C=C2)C)(C)C
Complexity
706
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
7
HeavyAtomCount
30
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
1
RotatableBondCount
7
Xlogp3
4.7
