Vitas-M small molecule compound
(8xi,9xi,14xi,17xi,20xi)-24,24-diphenylchola-5,23-dien-3-ol
Catalog ID
STL525913
SMILES OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3CCC2C(C/C=C(/c2ccccc2)\c2ccccc2)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 C36H46O MW 494.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H46O/c1-25(14-16-30(26-10-6-4-7-11-26)27-12-8-5-9-13-27)32-18-19-33-31-17-15-28-24-29(37)20-22-35(28,2)34(31)21-23-36(32,33)3/h4-13,15-16,25,29,31-34,37H,14,17-24H2,1-3H3/t25?,29?,31?,32?,33?,34?,35-,36+/m0/s1InChIKey
ZSDQQAARIIJNOV-OKJVJQRESA-NSynonyms
(10~(R)13~(R))17(55diphenylpent4en2yl)1013dimethyl234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3ol
(3S8S9S10R13R14S17R)17((R)55diphenylpent4en2yl)1013dimethyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ol
(8xi9xi14xi17xi20xi)2424diphenylchola523dien3ol
135639104
InChI=1SC36H46Oc125(141630(26106471126)27128591327)32181933311715282429(37)202235(282)34(31)212336(3233)3h41315162529313437H141724H213H3t25?29?31?32?33?34?3536+m0s1
MFCD01543280
O(C@H)1CC(C@)2(C(=CC(C@@H)3(C@@H)2CC(C@)2((C@H)3CC(C@@H)2(C@@H)(CC=C(c2ccccc2)c2ccccc2)C)C)C1)C
ZINC001772492129
ZINC001772492132
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