Cetadiol

(3S,8S,9S,10R,13R,14S,16R)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol

CAS: 3642-89-5

Molecular Formula	`C19H30O2`
Molecular Weight	290.4 g/mol
LogP	3.7
Topological Polar Surface Area	40.5 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	0
Exact Mass	290.22458
Heavy Atoms	21
Complexity	470.0

Chemical Identifiers

CAS Number	3642-89-5
SMILES	`CC12CCC3C(C1CC(C2)O)CC=C4C3(CCC(C4)O)C`
InChIKey	`CVCDJRPXEWJAAY-UVSUZTNJSA-N`

📖 Product Overview

Cetadiol (CAS: 3642-89-5) is a chemical compound with molecular formula C19H30O2 and molecular weight 290.4 g/mol. Its IUPAC systematic name is (3S,8S,9S,10R,13R,14S,16R)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol. LogP 3.7 Topological Polar Surface Area 40.5 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 2 Rotatable Bonds 0 Exact Mass 290.22458 Heavy Atoms 21 Complexity 470.0 InChI Key: CVCDJRPXEWJAAY-UVSUZTNJSA-N. SMILES: CC12CCC3C(C1CC(C2)O)CC=C4C3(CCC(C4)O)C.

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