Vitas-M small molecule compound
(3S,10S,13S,17S)-10,13,17-trimethylhexadecahydrospiro[cyclopenta[a]phenanthrene-3,2'-thiiran]-17-ol
Catalog ID
STL525166
SMILES C[C@]12CC[C@]3(CC1CCC1C2CC[C@]2(C1CC[C@]2(C)O)C)CS3
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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 C21H34OS MW 334.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H34OS/c1-18-10-11-21(13-23-21)12-14(18)4-5-15-16(18)6-8-19(2)17(15)7-9-20(19,3)22/h14-17,22H,4-13H2,1-3H3/t14?,15?,16?,17?,18-,19-,20-,21-/m0/s1InChIKey
NHSADEZTTCEMTD-RZVKDUKPSA-NSynonyms
(2S10S13S17S)101317trimethylhexadecahydrospiro(cyclopenta(a)phenanthrene32thiiran)17ol
(3~(S)10~(S)13~(S)17~(S))101317trimethylspiro(24567891112141516dodecahydro1~(H)cyclopenta(a)phenanthrene32thiirane)17ol
(3S10S13S17S)101317trimethylhexadecahydrospiro(cyclopenta(a)phenanthrene32thiiran)17ol
16395123
C(C@)12CC(C@)3(CC1CCC1C2CC(C@)2(C1CC(C@)2(C)O)C)CS3
InChI=1SC21H34OSc118101121(132321)1214(18)451516(18)6819(2)17(15)7920(193)22h141722H413H213H3t14?15?16?17?18192021m0s1
MFCD01082373
ZINC000004023326
ZINC000253499786
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