Vitas-M small molecule compound
(12aS)-6-(3-methoxyphenyl)-2-(3-phenylpropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537754
SMILES COc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCCc1ccccc1
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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 C30H29N3O3 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O3/c1-36-22-13-7-12-21(17-22)29-28-24(23-14-5-6-15-25(23)31-28)18-26-30(35)32(19-27(34)33(26)29)16-8-11-20-9-3-2-4-10-20/h2-7,9-10,12-15,17,26,29,31H,8,11,16,18-19H2,1H3/t26-,29?/m0/s1InChIKey
OWGFMPNXCJNULH-QUWDGAPNSA-NSynonyms
956927-77-8(12aS)6(3methoxyphenyl)2(3phenylpropyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(3methoxyphenyl)2(3phenylpropyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(3methoxyphenyl)6(3phenylpropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400152
956927778
COc1cccc(c1)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CCCc1ccccc1
InChI=1SC30H29N3O3c136221371221(1722)292824(2314561525(23)3128)182630(35)32(1927(34)33(26)29)168112093241020h27910121517262931H811161819H21H3t2629?m0s1
MFCD05670935
ZINC000002108787
ZINC000002108789
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