Vitas-M small molecule compound
(8xi,9xi,14xi)-3-hydroxy-16-methylpregna-5,16-dien-20-one
Catalog ID
STL524689
SMILES OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3CC(=C2C(=O)C)C)C)C1)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 C22H32O2 MW 328.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H32O2/c1-13-11-19-17-6-5-15-12-16(24)7-9-21(15,3)18(17)8-10-22(19,4)20(13)14(2)23/h5,16-19,24H,6-12H2,1-4H3/t16?,17?,18?,19?,21-,22-/m0/s1InChIKey
WYOKDIKHIXWWOC-VWSDOHLZSA-NSynonyms
(8xi9xi14xi)3hydroxy16methylpregna516dien20one
1((10~(R)13~(S))3hydroxy101316trimethyl23478911121415decahydro1~(H)cyclopenta(a)phenanthren17yl)ethanone
1((3S8R10R13S)3hydroxy101316trimethyl234789101112131415dodecahydro1Hcyclopenta(a)phenanthren17yl)ethanone
59977039
InChI=1SC22H32O2c11311191765151216(24)7921(153)18(17)81022(194)20(13)14(2)23h5161924H612H214H3t16?17?18?19?2122m0s1
MFCD01548200
O(C@H)1CC(C@)2(C(=CC(C@@H)3C2CC(C@)2(C3CC(=C2C(=O)C)C)C)C1)C
ZINC000004082193
ZINC001772491899
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