Vitas-M small molecule compound
(8xi,9xi,14xi,17beta)-4-chloro-17-hydroxy-17-methylandrosta-1,4-dien-3-one
Catalog ID
STL525540
SMILES O=C1C=C[C@]2(C(=C1Cl)CCC1C2CC[C@]2(C1CC[C@]2(C)O)C)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 C20H27ClO2 MW 334.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27ClO2/c1-18-9-8-16(22)17(21)15(18)5-4-12-13(18)6-10-19(2)14(12)7-11-20(19,3)23/h8-9,12-14,23H,4-7,10-11H2,1-3H3/t12?,13?,14?,18-,19+,20+/m1/s1InChIKey
AGUNEISBPXQOPA-QMDPVJTKSA-NSynonyms
(10~(R)13~(S)17~(S))4chloro17hydroxy101317trimethyl7891112141516octahydro6~(H)cyclopenta(a)phenanthren3one
(10R13S17S)4chloro17hydroxy101317trimethyl67891011121314151617dodecahydro3Hcyclopenta(a)phenanthren3one
(8xi9xi14xi17beta)4chloro17hydroxy17methylandrosta14dien3one
16395944
InChI=1SC20H27ClO2c1189816(22)17(21)15(18)541213(18)61019(2)14(12)71120(193)23h89121423H471011H213H3t12?13?14?1819+20+m1s1
MFCD01547059
O=C1C=C(C@)2(C(=C1Cl)CCC1C2CC(C@)2(C1CC(C@)2(C)O)C)C
ZINC000004026418
ZINC000253498871
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