Vitas-M small molecule compound
(12aR)-2-(2-hydroxy-2-phenylethyl)-6-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL527867
SMILES OC(c1ccccc1)CN1CC(=O)N2[C@@H](C1=O)Cc1c(C2CCc2ccccc2)[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 C30H29N3O3 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O3/c34-27(21-11-5-2-6-12-21)18-32-19-28(35)33-25(16-15-20-9-3-1-4-10-20)29-23(17-26(33)30(32)36)22-13-7-8-14-24(22)31-29/h1-14,25-27,31,34H,15-19H2/t25?,26-,27?/m1/s1InChIKey
VWBDAIDVIJWGOX-WTGGTCQISA-NSynonyms
(12aR)2(2hydroxy2phenylethyl)6(2phenylethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(2hydroxy2phenylethyl)6phenethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(R))6(2hydroxy2phenylethyl)2(2phenylethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
135639325
InChI=1SC30H29N3O3c3427(21115261221)18321928(35)3325(16152093141020)2923(1726(33)30(32)36)2213781424(22)3129h11425273134H1519H2t25?2627?m1s1
MFCD03661472
OC(c1ccccc1)CN1CC(=O)N2(C@H)(C1=O)Cc1c(C2CCc2ccccc2)(nH)c2c1cccc2
ZINC000016042598
ZINC000043741219
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