Vitas-M small molecule compound

N-({2-[(11aS)-5-(3-methoxyphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]phenyl}carbonyl)-L-alanine

Catalog ID
STL530504
SMILES COc1cccc(c1)C1N2[C@@H](Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)N[C@H](C(=O)O)C

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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 C30H26N4O6 MW 538.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N4O6/c1-16(29(37)38)31-27(35)20-11-4-6-13-23(20)34-28(36)24-15-21-19-10-3-5-12-22(19)32-25(21)26(33(24)30(34)39)17-8-7-9-18(14-17)40-2/h3-14,16,24,26,32H,15H2,1-2H3,(H,31,35)(H,37,38)/t16-,24-,26?/m0/s1
InChIKey
PVTIRADOJZIYSP-GORLQWCBSA-N
Synonyms
957033-48-6
(2~(S))2((2((15~(S))10(3methoxyphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzoyl)amino)propanoicacid
(2S)2(2((11aS)5(3methoxyphenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamido)propanoicacid
16404737
957033486
COc1cccc(c1)C1N2(C@@H)(Cc3c1(nH)c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)N(C@H)(C(=O)O)C
InChI=1SC30H26N4O6c116(29(37)38)3127(35)2011461323(20)3428(36)2415211910351222(19)3225(21)26(33(24)30(34)39)1787918(1417)402h31416242632H15H212H3(H3135)(H3738)t162426?m0s1
MFCD06767937
N((2((11aS)5(3methoxyphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)phenyl)carbonyl)Lalanine
ZINC000070700929
ZINC000070700931

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Available files

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