Vitas-M small molecule compound
(3S)-2-[2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)propanoyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid
Catalog ID
STK602524
SMILES OC(=O)[C@@H]1Cc2ccccc2CN1C(=O)C(n1c(O)nc2c(c1=O)cccc2)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 C21H19N3O5 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5/c1-12(24-19(26)15-8-4-5-9-16(15)22-21(24)29)18(25)23-11-14-7-3-2-6-13(14)10-17(23)20(27)28/h2-9,12,17H,10-11H2,1H3,(H,22,29)(H,27,28)/t12?,17-/m0/s1InChIKey
KEJLIXOIQLDOLK-TYJDENFWSA-NSynonyms
1213987-92-8(3S)2(2(24dioxo1Hquinazolin3yl)propanoyl)34dihydro1Hisoquinoline3carboxylicacid
(3S)2(2(2hydroxy4oxoquinazolin3(4H)yl)propanoyl)1234tetrahydroisoquinoline3carboxylicacid
1213987928
CC(C(=O)N1CC2=CC=CC=C2CC1C(=O)O)N3C(=O)C4=CC=CC=C4NC3=O
InChI=1SC21H19N3O5c112(2419(26)15845916(15)2221(24)29)18(25)231114732613(14)1017(23)20(27)28h291217H1011H21H3(H2229)(H2728)t12?17m0s1
MFCD18158606
OC(=O)(C@@H)1Cc2ccccc2CN1C(=O)C(n1c(O)nc2c(c1=O)cccc2)C
ZINC000011867216
ZINC000013629555
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