Estradiol phosphate

[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] dihydrogen phosphate

CAS: 4995-43-1

Molecular Formula	`C18H25O5P`
Molecular Weight	352.4 g/mol
LogP	2.9
Topological Polar Surface Area	87.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	352.14395
Heavy Atoms	24
Complexity	534.0

Chemical Identifiers

CAS Number	4995-43-1
SMILES	`CC12CCC3C(C1CCC2OP(=O)(O)O)CCC4=C3C=CC(=C4)O`
InChIKey	`BBWXLCKRYRQQPL-ZBRFXRBCSA-N`

📖 Product Overview

Estradiol phosphate (CAS: 4995-43-1) is a chemical compound with molecular formula C18H25O5P and molecular weight 352.4 g/mol. Its IUPAC systematic name is [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] dihydrogen phosphate. LogP 2.9 Topological Polar Surface Area 87.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 5 Rotatable Bonds 2 Exact Mass 352.14395 Heavy Atoms 24 Complexity 534.0 InChI Key: BBWXLCKRYRQQPL-ZBRFXRBCSA-N. SMILES: CC12CCC3C(C1CCC2OP(=O)(O)O)CCC4=C3C=CC(=C4)O.

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