Estramustine phosphate

cas: 4891-15-0 — see every product listed under this CAS number, including other names

Estramustine phosphate (CAS 4891-15-0) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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catalog numberHY-13627A-Get quote
cas4891-15-0
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Structural formula: {0} (CAS {1})

Estramustine phosphate is a steroid phosphate which is the 17-O-phospho derivative of estramustine. It is a carbamate ester, an organochlorine compound and a steroid phosphate. It is functionally related to an estramustine. It is a conjugate acid of an estramustine phosphate(2-).

Source: ChEBI

Identity
Molecular formulaC23H32Cl2NO6P
Molecular weight520.4 g/mol
IUPAC name[(8R,9S,13S,14S,17S)-13-methyl-17-phosphonooxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] N,N-bis(2-chloroethyl)carbamate
InChIKeyADFOJJHRTBFFOF-RBRWEJTLSA-N
SMILESC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OP(=O)(O)O)CCC4=C3C=CC(=C4)OC(=O)N(CCCl)CCCl

Computed by PubChem (NCBI)

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