Vitas-M small molecule compound
4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-(1,5-dimethyl-1H-pyrazol-3-yl)butanamide
Catalog ID
STL542833
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)Nc2nn(c(c2)C)C)NC(=O)C)cc(c1OC)OC
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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 C30H37N5O6 MW 563.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H37N5O6/c1-17-14-26(34-35(17)3)33-27(38)8-7-13-31-23-12-10-20-21(16-24(23)37)22(32-18(2)36)11-9-19-15-25(39-4)29(40-5)30(41-6)28(19)20/h10,12,14-16,22H,7-9,11,13H2,1-6H3,(H,31,37)(H,32,36)(H,33,34,38)/t22-/m0/s1InChIKey
BUZQBMXPPMRXOL-QFIPXVFZSA-NSynonyms
1574390-74-1(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(15dimethyl1Hpyrazol3yl)butanamide
1574390741
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(15dimethylpyrazol3yl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(15dimethyl1Hpyrazol3yl)butanamide
75491930
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)Nc2nn(c(c2)C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC30H37N5O6c1171426(3435(17)3)3327(38)8713312312102021(1624(23)37)22(3218(2)36)119191525(394)29(405)30(416)28(19)20h1012141622H791113H216H3(H3137)(H3236)(H333438)t22m0s1
ZINC000108449870
ZINC108449870
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.