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 nonyl carbonate (non-preferred name)
Catalog ID
STL553621
SMILES CCCCCCCCCOC(=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 C37H64O3 MW 556.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H64O3/c1-5-7-9-11-13-15-17-27-39-35(38)40-31-23-25-37(4)30(28-31)19-21-32-33-22-20-29(18-16-14-12-10-8-6-2)36(33,3)26-24-34(32)37/h19,29,31-34H,5-18,20-28H2,1-4H3InChIKey
AHRVDUVZERLVKK-UHFFFAOYSA-NSynonyms
(1013dimethyl17octyl234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)nonylcarbonate
(3S10R13R)1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylnonylcarbonate
1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylnonylcarbonate(nonpreferredname)
3525439
CCCCCCCCCOC(=O)O(C@H)1CC(C@)2(C(=CCC3C2CC(C@)2(C3CCC2CCCCCCCC)C)C1)C
InChI=1SC37H64O3c157911131517273935(38)4031232537(4)30(2831)19213233222029(1816141210862)36(333)262434(32)37h19293134H5182028H214H3
MFCD01364282
ZINC000504151196
ZINC000504151199
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