Vitas-M small molecule compound
(12aR)-6-[4-(propan-2-yl)phenyl]-2-propyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL527760
SMILES CCCN1CC(=O)N2[C@@H](C1=O)Cc1c(C2c2ccc(cc2)C(C)C)[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 C26H29N3O2 MW 415.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O2/c1-4-13-28-15-23(30)29-22(26(28)31)14-20-19-7-5-6-8-21(19)27-24(20)25(29)18-11-9-17(10-12-18)16(2)3/h5-12,16,22,25,27H,4,13-15H2,1-3H3/t22-,25?/m1/s1InChIKey
PMGBPXPQOCWDCQ-UFUCKMQHSA-NSynonyms
(12aR)6(4(propan2yl)phenyl)2propyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(4isopropylphenyl)2propyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(R))2(4propan2ylphenyl)6propyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
135639308
CCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)C(C)C)(nH)c2c1cccc2
InChI=1SC26H29N3O2c1413281523(30)2922(26(28)31)142019756821(19)2724(20)25(29)1811917(101218)16(2)3h51216222527H41315H213H3t2225?m1s1
MFCD03662001
ZINC000006310967
ZINC000006310970
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