Estra-1(10),2,4-triene-1,3,17-triol

(17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,3,17-triol

CAS: 4147-05-1

Molecular Formula	`C18H24O3`
Molecular Weight	288.4 g/mol
LogP	3.7
Topological Polar Surface Area	60.7 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	3
Rotatable Bonds	0
Exact Mass	288.17255
Heavy Atoms	21
Complexity	411.0

Chemical Identifiers

CAS Number	4147-05-1
SMILES	`CC12CCC3C(C1CCC2O)CCC4=C3C(=CC(=C4)O)O`
InChIKey	`BSBWEXLXIOSMDG-IEKYFPHUSA-N`

📖 Product Overview

Estra-1(10),2,4-triene-1,3,17-triol (CAS: 4147-05-1) is a chemical compound with molecular formula C18H24O3 and molecular weight 288.4 g/mol. Its IUPAC systematic name is (17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,3,17-triol. LogP 3.7 Topological Polar Surface Area 60.7 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 3 Rotatable Bonds 0 Exact Mass 288.17255 Heavy Atoms 21 Complexity 411.0 InChI Key: BSBWEXLXIOSMDG-IEKYFPHUSA-N. SMILES: CC12CCC3C(C1CCC2O)CCC4=C3C(=CC(=C4)O)O.

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