DTXSID50966324

(2S,3S,5S,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-2-morpholin-4-yl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one

CAS: 52-72-2

Molecular Formula	`C23H37NO3`
Molecular Weight	375.5 g/mol
LogP	3.1
Topological Polar Surface Area	49.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	1
Exact Mass	375.27734
Heavy Atoms	27
Complexity	602.0

Chemical Identifiers

CAS Number	52-72-2
SMILES	`CC12CCC3C(C1CCC2=O)CCC4C3(CC(C(C4)O)N5CCOCC5)C`
InChIKey	`KFWLDVAUZFLXMB-UZBJCSTBSA-N`

📖 Product Overview

DTXSID50966324 (CAS: 52-72-2) is a chemical compound with molecular formula C23H37NO3 and molecular weight 375.5 g/mol. Its IUPAC systematic name is (2S,3S,5S,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-2-morpholin-4-yl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one. LogP 3.1 Topological Polar Surface Area 49.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 1 Exact Mass 375.27734 Heavy Atoms 27 Complexity 602.0 InChI Key: KFWLDVAUZFLXMB-UZBJCSTBSA-N. SMILES: CC12CCC3C(C1CCC2=O)CCC4C3(CC(C(C4)O)N5CCOCC5)C.

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