Gramisterol structure

Gramisterol

4,10,13-trimethyl-17-(6-methyl-5-methylideneheptan-2-yl)-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Also Known As: Gramisterol|24-Methylenelophenol|4,10,13-trimethyl-17-(6-methyl-5-methylideneheptan-2-yl)-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

CAS: 1176-52-9
Molecular Formula C29H48O
Molecular Weight 412.3705 g/mol
LogP 8.8
Topological Polar Surface Area 20.2 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
Rotatable Bonds 5
Exact Mass 412.3705
Monoisotopic Mass 412.3705
Heavy Atoms 30
Complexity 688.0

Chemical Identifiers

CAS Number 1176-52-9
SMILES CC1C(CCC2(C1CC=C3C2CCC4(C3CCC4C(C)CCC(=C)C(C)C)C)C)O
InChIKey RSMKYRDCCSNYFM-UHFFFAOYSA-N

Product Overview

Gramisterol (CAS 1176-52-9), with molecular formula C29H48O and molecular weight 412.3705 g/mol. IUPAC: 4,10,13-trimethyl-17-(6-methyl-5-methylideneheptan-2-yl)-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol.

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