ESTRIOL 3-BENZOATE

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Catalog Number

ACM2137851

Product Name

ESTRIOL 3-BENZOATE

Structure

CAS

2137-85-1

Category

Heterocyclic Organic Compound

Synonyms

ESTRIOL3-BENZOATE, SCHEMBL8177995, 2137-85-1

IUPAC Name

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

Molecular Weight

392.487420 [g/mol]

Molecular Formula

C25H28O4

Canonical SMILES

CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5

InChI Key

XOFSFAAPNZBHAY-ROHWNPGJSA-N

H-Bond Acceptor

H-Bond Donor

MSDS

COA

Spec Sheet

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