Vitas-M small molecule compound
(12aS)-2-(5-hydroxypentyl)-6-(3,4,5-trimethoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL546033
SMILES OCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cc(OC)c(c(c2)OC)OC)[nH]c2c1cccc2
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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 C28H33N3O6 MW 507.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H33N3O6/c1-35-22-13-17(14-23(36-2)27(22)37-3)26-25-19(18-9-5-6-10-20(18)29-25)15-21-28(34)30(11-7-4-8-12-32)16-24(33)31(21)26/h5-6,9-10,13-14,21,26,29,32H,4,7-8,11-12,15-16H2,1-3H3/t21-,26?/m0/s1InChIKey
XMNIUZONIYFANF-GVNKFJBHSA-NSynonyms
956957-93-0(12aS)2(5hydroxypentyl)6(345trimethoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)2(5hydroxypentyl)6(345trimethoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6(5hydroxypentyl)2(345trimethoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399286
956957930
InChI=1SC28H33N3O6c135221317(1423(362)27(22)373)262519(189561020(18)2925)152128(34)30(117481232)1624(33)31(21)26h56910131421262932H47811121516H213H3t2126?m0s1
MFCD04142731
OCCCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2cc(OC)c(c(c2)OC)OC)(nH)c2c1cccc2
ZINC000002153558
ZINC000002153560
Check stock
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Check stock on Vitas-MAvailable files
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