alpha-Amyrin

(3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

CAS: 638-95-9

Molecular Formula	`C30H50O`
Molecular Weight	426.7 g/mol
LogP	9.0
Topological Polar Surface Area	20.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	1
Rotatable Bonds	0
Exact Mass	426.38617
Heavy Atoms	31
Complexity	779.0

Chemical Identifiers

CAS Number	638-95-9
SMILES	`CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C`
InChIKey	`FSLPMRQHCOLESF-SFMCKYFRSA-N`

📖 Product Overview

alpha-Amyrin (CAS: 638-95-9) is a chemical compound with molecular formula C30H50O and molecular weight 426.7 g/mol. Its IUPAC systematic name is (3S,4aR,6aR,6bS,8aR,11R,12S,12aR,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol. LogP 9.0 Topological Polar Surface Area 20.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 1 Rotatable Bonds 0 Exact Mass 426.38617 Heavy Atoms 31 Complexity 779.0 InChI Key: FSLPMRQHCOLESF-SFMCKYFRSA-N. SMILES: CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C.

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