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 undecanoate (non-preferred name)
Catalog ID
STL553655
SMILES CCCCCCCCCCC(=O)OC1CCC2(C(=CCC3C2CCC2(C3CCC2CCCCCCCC)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 C38H66O2 MW 554.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H66O2/c1-5-7-9-11-13-14-16-18-20-36(39)40-32-25-27-38(4)31(29-32)21-23-33-34-24-22-30(19-17-15-12-10-8-6-2)37(34,3)28-26-35(33)38/h21,30,32-35H,5-20,22-29H2,1-4H3InChIKey
PZOSZMBOXFRLSQ-UHFFFAOYSA-NSynonyms
(1013dimethyl17octyl234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)undecanoate
(3S10R13R)1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylundecanoate
1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylundecanoate(nonpreferredname)
3541125
CCCCCCCCCCC(=O)O(C@H)1CC(C@)2(C(=CCC3C2CC(C@)2(C3CCC2CCCCCCCC)C)C1)C
InChI=1SC38H66O2c157911131416182036(39)4032252738(4)31(2932)21233334242230(1917151210862)37(343)282635(33)38h21303235H5202229H214H3
MFCD01366434
ZINC000504206729
ZINC000504206732
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