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Nombre: 3,7β-dihydroxy-2-iodo-estra-1,3,5(10)-trien-17-one

IUPAC: (7S,8R,9S,13S,14S)-3,7-dihydroxy-2-iodo-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one

SMILES: C[C@]12CC[C@@H]3c4cc(I)c(O)cc4C[C@H](O)[C@H]3[C@@H]1CCC2=O

Canonical SMILES: CC12CCC3C(C1CCC2=O)C(CC4=CC(=C(C=C34)I)O)O

Fórmula molecular: C18H21IO3

Masa molecular: 412.30

InChIKey: HJBNIOREAKOTNY-VYWVQWIVSA-N

InChI: InChI=1S/C18H21IO3/c1-18-5-4-10-11-8-13(19)14(20)6-9(11)7-15(21)17(10)12(18)2-3-16(18)22/h6,8,10,12,15,17,20-21H,2-5,7H2,1H3/t10-,12+,15+,17-,18+/m1/s1

PubChem CID: 11611293 →

Sinónimos

SCHEMBL4588776HJBNIOREAKOTNY-VYWVQWIVSA-N3,7beta-Dihydroxy-2-iodo-estra-1,3,5(10)-trien-17-one

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