Vitas-M small molecule compound
N-[(7S)-1,2,3-trimethoxy-9-oxo-10-({2-oxo-2-[4-(2,3,4-trimethoxybenzyl)piperazin-1-yl]ethyl}amino)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Catalog ID
STL540689
SMILES COc1c(OC)ccc(c1OC)CN1CCN(CC1)C(=O)CNc1ccc2c(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 C37H46N4O9 MW 690.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H46N4O9/c1-22(42)39-27-11-8-23-18-31(46-3)36(49-6)37(50-7)33(23)25-10-12-28(29(43)19-26(25)27)38-20-32(44)41-16-14-40(15-17-41)21-24-9-13-30(45-2)35(48-5)34(24)47-4/h9-10,12-13,18-19,27H,8,11,14-17,20-21H2,1-7H3,(H,38,43)(H,39,42)/t27-/m0/s1InChIKey
QMLAOJWRODIRLR-MHZLTWQESA-NSynonyms
1574351-94-2(S)N(123trimethoxy9oxo10((2oxo2(4(234trimethoxybenzyl)piperazin1yl)ethyl)amino)5679tetrahydrobenzo(a)heptalen7yl)acetamide
~(N)((7~(S))123trimethoxy9oxo10((2oxo2(4((234trimethoxyphenyl)methyl)piperazin1yl)ethyl)amino)67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1574351942
75492279
COc1c(OC)ccc(c1OC)CN1CCN(CC1)C(=O)CNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC37H46N4O9c122(42)3927118231831(463)36(496)37(507)33(23)25101228(29(43)1926(25)27)382032(44)41161440(151741)212491330(452)35(485)34(24)474h9101213181927H81114172021H217H3(H3843)(H3942)t27m0s1
N((7S)123trimethoxy9oxo10((2oxo2(4(234trimethoxybenzyl)piperazin1yl)ethyl)amino)5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000150653721
ZINC150653721
Check stock
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Check stock on Vitas-MAvailable files
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