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 3-methylbutyl carbonate (non-preferred name)
Catalog ID
STL553664
SMILES CCCCCCCCC1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OC(=O)OCCC(C)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 C33H56O3 MW 500.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H56O3/c1-6-7-8-9-10-11-12-25-14-16-29-28-15-13-26-23-27(36-31(34)35-22-19-24(2)3)17-20-33(26,5)30(28)18-21-32(25,29)4/h13,24-25,27-30H,6-12,14-23H2,1-5H3InChIKey
RYYYEQDZTJMHCQ-UHFFFAOYSA-NSynonyms
(1013dimethyl17octyl234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)3methylbutylcarbonate
(3S10R13R)1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3ylisopentylcarbonate
1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yl3methylbutylcarbonate(nonpreferredname)
3842531
CCCCCCCCC1CCC2(C@)1(C)CCC1C2CC=C2(C@)1(C)CC(C@@H)(C2)OC(=O)OCCC(C)C
InChI=1SC33H56O3c1678910111225141629281513262327(3631(34)35221924(2)3)172033(265)30(28)182132(2529)4h1324252730H6121423H215H3
MFCD01366443
ZINC000070665538
ZINC000504372666
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