Compound C19H25BrO3

(8S,9S,11S,13S,14S,16R,17R)-16-bromo-11-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol

CAS: 82123-98-6

Molecular Formula	`C19H25BrO3`
Molecular Weight	381.3 g/mol
LogP	3.3
Topological Polar Surface Area	49.7 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	1
Exact Mass	380.09872
Heavy Atoms	23
Complexity	458.0

Chemical Identifiers

CAS Number	82123-98-6
SMILES	`CC12CC(C3C(C1CC(C2O)Br)CCC4=C3C=CC(=C4)O)OC`
InChIKey	`FERUVNCWJYIAQM-RUOITVIXSA-N`

📖 Product Overview

Compound C19H25BrO3 (CAS: 82123-98-6) is a chemical compound with molecular formula C19H25BrO3 and molecular weight 381.3 g/mol. Its IUPAC systematic name is (8S,9S,11S,13S,14S,16R,17R)-16-bromo-11-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol. LogP 3.3 Topological Polar Surface Area 49.7 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 3 Rotatable Bonds 1 Exact Mass 380.09872 Heavy Atoms 23 Complexity 458.0 InChI Key: FERUVNCWJYIAQM-RUOITVIXSA-N. SMILES: CC12CC(C3C(C1CC(C2O)Br)CCC4=C3C=CC(=C4)O)OC.

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