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 octanoate (non-preferred name)
Catalog ID
STL553652
SMILES CCCCCCCCC1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OC(=O)CCCCCCC
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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 C35H60O2 MW 512.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H60O2/c1-5-7-9-11-13-14-16-27-19-21-31-30-20-18-28-26-29(37-33(36)17-15-12-10-8-6-2)22-24-35(28,4)32(30)23-25-34(27,31)3/h18,27,29-32H,5-17,19-26H2,1-4H3InChIKey
JGUZEORGVGLUSD-UHFFFAOYSA-NSynonyms
(1013dimethyl17octyl234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)octanoate
(3S10R13R)1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yloctanoate
1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yloctanoate(nonpreferredname)
3274335
CCCCCCCCC1CCC2(C@)1(C)CCC1C2CC=C2(C@)1(C)CC(C@@H)(C2)OC(=O)CCCCCCC
InChI=1SC35H60O2c15791113141627192131302018282629(3733(36)17151210862)222435(284)32(30)232534(2731)3h18272932H5171926H214H3
MFCD01366433
ZINC000070665890
ZINC000504028812
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