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 pentanoate (non-preferred name)
Catalog ID
STL553649
SMILES CCCCCCCCC1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OC(=O)CCCC
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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 C32H54O2 MW 470.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H54O2/c1-5-7-9-10-11-12-13-24-16-18-28-27-17-15-25-23-26(34-30(33)14-8-6-2)19-21-32(25,4)29(27)20-22-31(24,28)3/h15,24,26-29H,5-14,16-23H2,1-4H3InChIKey
HJPRFXLYHWGFAI-UHFFFAOYSA-NSynonyms
(1013dimethyl17octyl234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)pentanoate
(3S10R13R)1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylpentanoate
1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylpentanoate(nonpreferredname)
3402934
CCCCCCCCC1CCC2(C@)1(C)CCC1C2CC=C2(C@)1(C)CC(C@@H)(C2)OC(=O)CCCC
InChI=1SC32H54O2c15791011121324161828271715252326(3430(33)14862)192132(254)29(27)202231(2428)3h15242629H5141623H214H3
MFCD01366430
ZINC000070665652
ZINC000504267984
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