Compound C30H35NO4S

[(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] 5-(dimethylamino)naphthalene-1-sulfonate

CAS: 30808-48-1

Molecular Formula	`C30H35NO4S`
Molecular Weight	505.7 g/mol
LogP	5.5
Topological Polar Surface Area	75.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	5
Rotatable Bonds	4
Exact Mass	505.22867
Heavy Atoms	36
Complexity	901.0

Chemical Identifiers

CAS Number	30808-48-1
SMILES	`CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OS(=O)(=O)C5=CC=CC6=C5C=CC=C6N(C)C`
InChIKey	`HPCHMBPQUJEXLJ-XDLBVFQSSA-N`

📖 Product Overview

Compound C30H35NO4S (CAS: 30808-48-1) is a chemical compound with molecular formula C30H35NO4S and molecular weight 505.7 g/mol. Its IUPAC systematic name is [(8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] 5-(dimethylamino)naphthalene-1-sulfonate. LogP 5.5 Topological Polar Surface Area 75.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 5 Rotatable Bonds 4 Exact Mass 505.22867 Heavy Atoms 36 Complexity 901.0 InChI Key: HPCHMBPQUJEXLJ-XDLBVFQSSA-N. SMILES: CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OS(=O)(=O)C5=CC=CC6=C5C=CC=C6N(C)C.

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