estradiol-17α

Chemical Formula:

C₁₈H₂₄O₂

Molecular Weight:

272.386 Daltons

Monoisotopic Mass:

272.1776300146 Daltons

SMILES:

CC23(CC[CH]1(C4(C=CC(O)=CC(CC[CH]1[CH](CCC(O)2)3)=4)))

InChI:

1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17-,18+/m1/s1

InChIKey:

VOXZDWNPVJITMN-SFFUCWETSA-N

Synonyms

Databases

MetaCyc: CPD-351

RefMet: Estradiol-17alpha

HMDB: HMDB00429

LIPID MAPS: LMST02010029

ChemSpider: 61840

PubChem (CID): 68570

ChEBI: 17160

KEGG: C02537

Seed: cpd01668

MetaNetX: MNXM2462

CAS: 57-91-0