Vitas-M small molecule compound
(12bS)-7-(2-ethoxy-3-methoxyphenyl)-12b-methyl-2-[3-(morpholin-4-yl)propyl]-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL530856
SMILES CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCCN1CCOCC1
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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 C31H38N4O5 MW 546.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H38N4O5/c1-4-40-28-21(10-7-12-25(28)38-3)23-19-35-26(36)20-34(14-8-13-33-15-17-39-18-16-33)30(37)31(35,2)29-27(23)22-9-5-6-11-24(22)32-29/h5-7,9-12,23,32H,4,8,13-20H2,1-3H3/t23?,31-/m0/s1InChIKey
IJPQUAHZIRAAQB-HPTWYVLESA-NSynonyms
957047-90-4(12bS)7(2ethoxy3methoxyphenyl)12bmethyl2(3(morpholin4yl)propyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(2ethoxy3methoxyphenyl)12bmethyl2(3morpholinopropyl)2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(2ethoxy3methoxyphenyl)2methyl4(3morpholin4ylpropyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402685
957047904
CCOc1c(OC)cccc1C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCCN1CCOCC1
InChI=1SC31H38N4O5c14402821(1071225(28)383)23193526(36)2034(1481333151739181633)30(37)31(352)2927(23)229561124(22)3229h579122332H481320H213H3t23?31m0s1
MFCD06494164
ZINC000070692386
ZINC000070692387
Check stock
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Check stock on Vitas-MAvailable files
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