Vitas-M small molecule compound
(12bS)-9-methoxy-12b-methyl-2-[3-(propan-2-yloxy)propyl]-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL542543
SMILES COc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)CCCOC(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 C22H29N3O4 MW 399.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N3O4/c1-14(2)29-11-5-9-24-13-19(26)25-10-8-16-17-12-15(28-4)6-7-18(17)23-20(16)22(25,3)21(24)27/h6-7,12,14,23H,5,8-11,13H2,1-4H3/t22-/m0/s1InChIKey
JIMDVUMCMNDWJB-QFIPXVFZSA-NSynonyms
956795-68-9(12bS)9methoxy12bmethyl2(3(propan2yloxy)propyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(S))13methoxy2methyl4(3propan2yloxypropyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)11(16)1214tetraene36dione
(S)2(3isopropoxypropyl)9methoxy12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
6569261
956795689
COc1ccc2c(c1)c1CCN3(C@)(c1(nH)2)(C)C(=O)N(CC3=O)CCCOC(C)C
InChI=1SC22H29N3O4c114(2)291159241319(26)2510816171215(284)6718(17)2320(16)22(253)21(24)27h67121423H581113H214H3t22m0s1
MFCD04144093
ZINC000004062254
ZINC4062254
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