Vitas-M small molecule compound
6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-{3-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]phenyl}hexanamide
Catalog ID
STL545289
SMILES COCc1[nH]nc(n1)c1cccc(c1)NC(=O)CCCCCNc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)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 C37H44N6O7 MW 684.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H44N6O7/c1-22(44)39-28-15-13-23-19-31(48-3)35(49-4)36(50-5)34(23)26-14-16-29(30(45)20-27(26)28)38-17-8-6-7-12-33(46)40-25-11-9-10-24(18-25)37-41-32(21-47-2)42-43-37/h9-11,14,16,18-20,28H,6-8,12-13,15,17,21H2,1-5H3,(H,38,45)(H,39,44)(H,40,46)(HInChIKey
RIGQZLYIJPXIOY-NDEPHWFRSA-NSynonyms
1630917-34-8(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3(3(methoxymethyl)1H124triazol5yl)phenyl)hexanamide
1630917348
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(3(5(methoxymethyl)1~(H)124triazol3yl)phenyl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3(5(methoxymethyl)1H124triazol3yl)phenyl)hexanamide
91638606
COCc1n(nH)c(n1)c1cccc(c1)NC(=O)CCCCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC37H44N6O7c122(44)39281513231931(483)35(494)36(505)34(23)26141629(30(45)2027(26)28)38178671233(46)40251191024(1825)374132(21472)424337h9111416182028H681213151721H215H3(H3845)(H3944)(H4046)(H414243)t28m0s1
ZINC000217920434
ZINC217920434
Check stock
See real-time availability and sample size for STL545289 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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