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 2-fluorophenyl carbonate (non-preferred name)
Catalog ID
STL553636
SMILES CCCCCCCCC1CCC2C1(C)CCC1C2CC=C2C1(C)CCC(C2)OC(=O)Oc1ccccc1F
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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 C34H49FO3 MW 524.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H49FO3/c1-4-5-6-7-8-9-12-24-16-18-28-27-17-15-25-23-26(37-32(36)38-31-14-11-10-13-30(31)35)19-21-34(25,3)29(27)20-22-33(24,28)2/h10-11,13-15,24,26-29H,4-9,12,16-23H2,1-3H3InChIKey
PGLSEWFLYPCBSX-UHFFFAOYSA-NSynonyms
(1013dimethyl17octyl234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)(2fluorophenyl)carbonate
(3S8S9S10R13R14S17S)1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yl(2fluorophenyl)carbonate
1013dimethyl17octyl2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yl2fluorophenylcarbonate(nonpreferredname)
3537171
CCCCCCCC(C@H)1CC(C@@H)2(C@)1(C)CC(C@H)1(C@H)2CC=C2(C@)1(C)CC(C@@H)(C2)OC(=O)Oc1ccccc1F
InChI=1SC34H49FO3c14567891224161828271715252326(3732(36)38311411101330(31)35)192134(253)29(27)202233(2428)2h10111315242629H49121623H213H3
MFCD00984758
ZINC000504533374
ZINC000504533377
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