Vitas-M small molecule compound
(12bS)-7-(2-ethoxy-3-methoxyphenyl)-2,12b-dimethyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL528902
SMILES CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)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 C25H27N3O4 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4/c1-5-32-22-15(10-8-12-19(22)31-4)17-13-28-20(29)14-27(3)24(30)25(28,2)23-21(17)16-9-6-7-11-18(16)26-23/h6-12,17,26H,5,13-14H2,1-4H3/t17?,25-/m0/s1InChIKey
SOZNDALMAYKEFU-HHPDBAQJSA-NSynonyms
956995-03-2(12bS)7(2ethoxy3methoxyphenyl)212bdimethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(2ethoxy3methoxyphenyl)212bdimethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(2ethoxy3methoxyphenyl)24dimethyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16403305
956995032
CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)C
InChI=1SC25H27N3O4c15322215(1081219(22)314)17132820(29)1427(3)24(30)25(282)2321(17)169671118(16)2623h6121726H51314H214H3t17?25m0s1
MFCD06495540
ZINC000008789640
ZINC000008789641
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