Vitas-M small molecule compound

(12bS)-2-(4-methoxybenzyl)-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
STL529037
SMILES COc1ccc(cc1)CN1CC(=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 C33H35N3O5 MW 553.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H35N3O5/c1-20(2)41-27-15-12-22(16-28(27)40-5)25-18-36-29(37)19-35(17-21-10-13-23(39-4)14-11-21)32(38)33(36,3)31-30(25)24-8-6-7-9-26(24)34-31/h6-16,20,25,34H,17-19H2,1-5H3/t25?,33-/m0/s1
InChIKey
SFVIIBCOAAAMHD-ZEWJHAJUSA-N
Synonyms
956826-81-6
(12bS)2(4methoxybenzyl)7(3methoxy4(propan2yloxy)phenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4isopropoxy3methoxyphenyl)2(4methoxybenzyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4((4methoxyphenyl)methyl)9(3methoxy4propan2yloxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16404840
956826816
COc1ccc(cc1)CN1CC(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1C(C2)c1ccc(c(c1)OC)OC(C)C)cccc3
InChI=1SC33H35N3O5c120(2)4127151222(1628(27)405)25183629(37)1935(1721101323(394)141121)32(38)33(363)3130(25)24867926(24)3431h616202534H1719H215H3t25?33m0s1
MFCD06768234
ZINC000070701076
ZINC000070701078

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Available files

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