Vitas-M small molecule compound
(2R)-({(2S)-4-methyl-2-[(11bS)-11b-methyl-1,3-dioxo-5,6,11,11b-tetrahydro-1H-imidazo[1',5':1,2]pyrido[3,4-b]indol-2(3H)-yl]pentanoyl}amino)(phenyl)ethanoic acid
Catalog ID
STL528901
SMILES CC(C[C@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C(=O)N[C@H](c1ccccc1)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 C28H30N4O5 MW 502.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O5/c1-16(2)15-21(24(33)30-22(25(34)35)17-9-5-4-6-10-17)32-26(36)28(3)23-19(13-14-31(28)27(32)37)18-11-7-8-12-20(18)29-23/h4-12,16,21-22,29H,13-15H2,1-3H3,(H,30,33)(H,34,35)/t21-,22+,28-/m0/s1InChIKey
ZFZSSNJEHXIXAP-TYPXCFOJSA-NSynonyms
956966-84-0(2~(R))2(((2~(S))4methyl2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)pentanoyl)amino)2phenylaceticacid
(2R)(((2S)4methyl2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)pentanoyl)amino)(phenyl)ethanoicacid
(R)2((S)4methyl2((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)pentanamido)2phenylaceticacid
16402424
956966840
CC(C(C@H)(N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)C(=O)N(C@H)(c1ccccc1)C(=O)O)C
InChI=1SC28H30N4O5c116(2)1521(24(33)3022(25(34)35)1795461017)3226(36)28(3)2319(131431(28)27(32)37)1811781220(18)2923h41216212229H1315H213H3(H3033)(H3435)t2122+28m0s1
ZINC000012876937
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.