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Estradiol hemihydrate- CAS 35380-71-3

CAS No.:

35380-71-3

PubChem Substance ID: 441585708

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C18H24O2 · 0.5H2O
PRODUCT  DETAILS
Synonyms:

β-Estradiol hemihydrate, 3,17β-Dihydroxy-1,3,5(10)-estratriene, 1,3,5-Estratriene-3,17β-diol

Molecular Formula:

C18H24O2 · 0.5H2O

Molecular Weight:281.39
Cas No:35380-71-3
Cat No:A001240
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For research use only. Not Intended for Therapeutic Use!

Cas No:35380-71-3
Product-Name:Estradiol hemihydrate
Related Cas:50-28-2
IUPAC Name:(8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol;hydrate
MDL No:MFCD23102821
InChI:InChI=1S/2C18H24O2.H2O/c2*1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20;/h2*3,5,10,14-17,19-20H,2,4,6-9H2,1H3;1H2/t2*14-,15-,16+,17+,18+;/m11./s1
InChIKey:ZVVGLAMWAQMPDR-WVEWYJOQSA-N
SMILES:CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O.CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O.O
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