Vitas-M small molecule compound
N~2~-({2-[(11aS)-1,3-dioxo-5-[4-(propan-2-yl)phenyl]-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]phenyl}carbonyl)-L-asparagine
Catalog ID
STL530232
SMILES NC(=O)C[C@@H](C(=O)O)NC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1ccc(cc1)C(C)C)c1c(C2)c2ccccc2[nH]1
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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 C33H31N5O6 MW 593.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31N5O6/c1-17(2)18-11-13-19(14-12-18)29-28-22(20-7-3-5-9-23(20)35-28)15-26-31(41)38(33(44)37(26)29)25-10-6-4-8-21(25)30(40)36-24(32(42)43)16-27(34)39/h3-14,17,24,26,29,35H,15-16H2,1-2H3,(H2,34,39)(H,36,40)(H,42,43)/t24-,26-,29?/m0/s1InChIKey
NIVVVXSDRYUPGY-DCGIVOCHSA-NSynonyms
956776-15-1(2~(S))4amino2((2((15~(S))1214dioxo10(4propan2ylphenyl)81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzoyl)amino)4oxobutanoicacid
(2S)4amino2(2((11aS)5(4isopropylphenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamido)4oxobutanoicacid
16406073
956776151
InChI=1SC33H31N5O6c117(2)18111319(141218)292822(20735923(20)3528)152631(41)38(33(44)37(26)29)251064821(25)30(40)3624(32(42)43)1627(34)39h3141724262935H1516H212H3(H23439)(H3640)(H4243)t242629?m0s1
N~2~((2((11aS)13dioxo5(4(propan2yl)phenyl)561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)phenyl)carbonyl)Lasparagine
NC(=O)C(C@@H)(C(=O)O)NC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1ccc(cc1)C(C)C)c1c(C2)c2ccccc2(nH)1
ZINC000070706830
ZINC000070706832
Check stock
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