Vitas-M small molecule compound
(12bS)-2-ethyl-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
STL530823
SMILES CCN1CC(=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 C27H31N3O4 MW 461.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O4/c1-6-29-15-23(31)30-14-19(17-11-12-21(34-16(2)3)22(13-17)33-5)24-18-9-7-8-10-20(18)28-25(24)27(30,4)26(29)32/h7-13,16,19,28H,6,14-15H2,1-5H3/t19?,27-/m0/s1InChIKey
NKTVOUJVPHUOPY-NZVRHLSZSA-NSynonyms
956929-31-0(12bS)2ethyl7(3methoxy4(propan2yloxy)phenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2ethyl7(4isopropoxy3methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4ethyl9(3methoxy4propan2yloxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16403444
956929310
CCN1CC(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1C(C2)c1ccc(c(c1)OC)OC(C)C)cccc3
InChI=1SC27H31N3O4c16291523(31)301419(17111221(3416(2)3)22(1317)335)24189781020(18)2825(24)27(304)26(29)32h713161928H61415H215H3t19?27m0s1
MFCD06495804
ZINC000008789804
ZINC000012880238
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