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N-{(2S)-3-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]butanoyl}-L-phenylalanine

Catalog ID
STL530122
SMILES OC(=O)[C@@H](NC(=O)[C@@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C(C)C)Cc1ccccc1

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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)22(24(33)30-21(25(34)35)15-17-9-5-4-6-10-17)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/s1
InChIKey
ICQSMOIRUNOHQP-VPYPWEPUSA-N
Synonyms
956973-84-5
(2~(S))2(((2~(S))3methyl2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)butanoyl)amino)3phenylpropanoicacid
(S)2((S)3methyl2((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)butanamido)3phenylpropanoicacid
16402992
956973845
InChI=1SC28H30N4O5c116(2)22(24(33)3021(25(34)35)151795461017)3226(36)28(3)2319(131431(28)27(32)37)1811781220(18)2923h41216212229H1315H213H3(H3033)(H3435)t212228m0s1
N((2S)3methyl2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)butanoyl)Lphenylalanine
OC(=O)(C@@H)(NC(=O)(C@@H)(N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)C(C)C)Cc1ccccc1
ZINC000008789250
ZINC8789250

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Available files

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