Vitas-M small molecule compound
6-{[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[5-(methoxymethyl)-1H-1,2,4-triazol-3-yl]hexanamide
Catalog ID
STL549498
SMILES COCc1[nH]nc(n1)NC(=O)CCCCCNc1ccc2c(cc1=O)C(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 C31H40N6O7 MW 608.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H40N6O7/c1-18(38)33-22-12-10-19-15-25(42-3)29(43-4)30(44-5)28(19)20-11-13-23(24(39)16-21(20)22)32-14-8-6-7-9-27(40)35-31-34-26(17-41-2)36-37-31/h11,13,15-16,22H,6-10,12,14,17H2,1-5H3,(H,32,39)(H,33,38)(H2,34,35,36,37,40)InChIKey
AJEZWSRMYYZJEB-UHFFFAOYSA-NSynonyms
(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(3(methoxymethyl)1H124triazol5yl)hexanamide
132286108
6((7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(5(methoxymethyl)1H124triazol3yl)hexanamide
6((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(5(methoxymethyl)1~(H)124triazol3yl)hexanamide
COCc1n(nH)c(n1)NC(=O)CCCCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC31H40N6O7c118(38)33221210191525(423)29(434)30(445)28(19)20111323(24(39)1621(20)22)3214867927(40)35313426(17412)363731h1113151622H610121417H215H3(H3239)(H3338)(H23435363740)
MFCD31757022
ZINC000524729611
ZINC000888089406
Check stock
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Check stock on Vitas-MAvailable files
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