Vitas-M small molecule compound
10,13-dimethyl-17-octyl-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl hexanoate (non-preferred name)
Catalog ID
STL553650
SMILES CCCCCCCCC1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OC(=O)CCCCC
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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 C33H56O2 MW 484.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H56O2/c1-5-7-9-10-11-13-14-25-17-19-29-28-18-16-26-24-27(35-31(34)15-12-8-6-2)20-22-33(26,4)30(28)21-23-32(25,29)3/h16,25,27-30H,5-15,17-24H2,1-4H3InChIKey
QLNPHOFFQQFVKE-UHFFFAOYSA-NSynonyms
(1013dimethyl17octyl234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)hexanoate
(3S8S9S10R13R14S17S)1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylhexanoate
1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylhexanoate(nonpreferredname)
4300596
CCCCCCCC(C@H)1CC(C@@H)2(C@)1(C)CC(C@H)1(C@H)2CC=C2(C@)1(C)CC(C@@H)(C2)OC(=O)CCCCC
InChI=1SC33H56O2c15791011131425171929281816262427(3531(34)1512862)202233(264)30(28)212332(2529)3h16252730H5151724H214H3
MFCD01366431
ZINC000504568056
ZINC000504568059
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