Vitas-M small molecule compound
(12bS)-2-(2-methoxyethyl)-7-[3-methoxy-4-(propan-2-yloxy)phenyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL530001
SMILES COCCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1ccc(c(c1)OC)OC(C)C)cccc3
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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 C28H33N3O5 MW 491.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O5/c1-17(2)36-22-11-10-18(14-23(22)35-5)20-15-31-24(32)16-30(12-13-34-4)27(33)28(31,3)26-25(20)19-8-6-7-9-21(19)29-26/h6-11,14,17,20,29H,12-13,15-16H2,1-5H3/t20?,28-/m0/s1InChIKey
GGZPIALVGOOZNR-GPIXMLASSA-NSynonyms
956925-70-5(12bS)2(2methoxyethyl)7(3methoxy4(propan2yloxy)phenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4isopropoxy3methoxyphenyl)2(2methoxyethyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4(2methoxyethyl)9(3methoxy4propan2yloxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402151
956925705
COCCN1CC(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1C(C2)c1ccc(c(c1)OC)OC(C)C)cccc3
InChI=1SC28H33N3O5c117(2)3622111018(1423(22)355)20153124(32)1630(1213344)27(33)28(313)2625(20)19867921(19)2926h61114172029H12131516H215H3t20?28m0s1
MFCD06493018
ZINC000012874467
ZINC000012874473
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