Vitas-M small molecule compound

(12bS)-2-(3,4-dimethoxybenzyl)-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
STL528811
SMILES COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)Cc1ccc(c(c1)OC)OC

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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 C34H37N3O6 MW 583.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H37N3O6/c1-20(2)43-27-14-12-22(16-29(27)42-6)24-18-37-30(38)19-36(17-21-11-13-26(40-4)28(15-21)41-5)33(39)34(37,3)32-31(24)23-9-7-8-10-25(23)35-32/h7-16,20,24,35H,17-19H2,1-6H3/t24?,34-/m0/s1
InChIKey
IYJVPNFBLDLPOE-NEYGVQFESA-N
Synonyms
956948-48-4
(12bS)2(34dimethoxybenzyl)7(3methoxy4(propan2yloxy)phenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2(34dimethoxybenzyl)7(4isopropoxy3methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4((34dimethoxyphenyl)methyl)9(3methoxy4propan2yloxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16404837
956948484
COc1cc(ccc1OC(C)C)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)Cc1ccc(c(c1)OC)OC
InChI=1SC34H37N3O6c120(2)4327141222(1629(27)426)24183730(38)1936(1721111326(404)28(1521)415)33(39)34(373)3231(24)239781025(23)3532h716202435H1719H216H3t24?34m0s1
MFCD06768215
ZINC000070701071
ZINC000070701073

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Available files

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