Vitas-M small molecule compound
(8xi,9xi,10xi,14xi)-17-hydroxyestr-4-en-3-one
Catalog ID
STL525383
SMILES O=C1CCC2C(=C1)CCC1C2CC[C@]2(C1CCC2O)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H26O2 MW 274.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13?,14?,15?,16?,17?,18-/m0/s1InChIKey
NPAGDVCDWIYMMC-KXGAMWBWSA-NSynonyms
(13~(S))17hydroxy13methyl2678910111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3one
(8R9S13S14S)17hydroxy13methyl67891011121314151617dodecahydro1Hcyclopenta(a)phenanthren3(2H)one
(8xi9xi10xi14xi)17hydroxyestr4en3one
44135671
InChI=1SC18H26O2c1189814135312(19)1011(13)2415(14)16(18)6717(18)20h10131720H29H21H3t13?14?15?16?17?18m0s1
MFCD01545705
O=C1CCC2C(=C1)CC(C@@H)1(C@@H)2CC(C@)2((C@H)1CCC2O)C
ZINC000001320059
ZINC000253497897
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