Vitas-M small molecule compound
N-{(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}-D-valine
Catalog ID
STL529264
SMILES CC(C[C@H](N1C(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cccc3)C(=O)N[C@@H](C(=O)O)C(C)C)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 C25H32N4O5 MW 468.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O5/c1-13(2)12-18(21(30)27-19(14(3)4)22(31)32)29-23(33)25(5)20-16(10-11-28(25)24(29)34)15-8-6-7-9-17(15)26-20/h6-9,13-14,18-19,26H,10-12H2,1-5H3,(H,27,30)(H,31,32)/t18-,19+,25-/m0/s1InChIKey
VJVAHPQSCCPZMJ-CEYNDMKZSA-NSynonyms
956819-88-8(2~(R))3methyl2(((2~(S))4methyl2((2~(S))2methyl35dioxo4616triazatetracyclo(7700^(26)0^(1015))hexadeca1(9)101214tetraen4yl)pentanoyl)amino)butanoicacid
(R)3methyl2((S)4methyl2((S)11bmethyl13dioxo56dihydro1Himidazo(1512)pyrido(34b)indol2(3H11H11bH)yl)pentanamido)butanoicacid
16402780
956819888
CC(C(C@H)(N1C(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cccc3)C(=O)N(C@@H)(C(=O)O)C(C)C)C
InChI=1SC25H32N4O5c113(2)1218(21(30)2719(14(3)4)22(31)32)2923(33)25(5)2016(101128(25)24(29)34)15867917(15)2620h691314181926H1012H215H3(H2730)(H3132)t1819+25m0s1
N((2S)4methyl2((11bS)11bmethyl13dioxo561111btetrahydro1Himidazo(1512)pyrido(34b)indol2(3H)yl)pentanoyl)Dvaline
ZINC000008789099
ZINC8789099
Check stock
See real-time availability and sample size for STL529264 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.