Vitas-M small molecule compound
N-[(7S)-1,2,3-trimethoxy-9-oxo-10-({4-oxo-4-[4-(2,3,4-trimethoxybenzyl)piperazin-1-yl]butyl}amino)-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide
Catalog ID
STL541678
SMILES COc1c(OC)ccc(c1OC)CN1CCN(CC1)C(=O)CCCNc1ccc2c(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 C39H50N4O9 MW 718.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H50N4O9/c1-24(44)41-29-13-10-25-21-33(48-3)38(51-6)39(52-7)35(25)27-12-14-30(31(45)22-28(27)29)40-16-8-9-34(46)43-19-17-42(18-20-43)23-26-11-15-32(47-2)37(50-5)36(26)49-4/h11-12,14-15,21-22,29H,8-10,13,16-20,23H2,1-7H3,(H,40,45)(H,41,44)/t29-/InChIKey
DKEAKZLDZANCQT-LJAQVGFWSA-NSynonyms
1574353-62-0(S)N(123trimethoxy9oxo10((4oxo4(4(234trimethoxybenzyl)piperazin1yl)butyl)amino)5679tetrahydrobenzo(a)heptalen7yl)acetamide
~(N)((7~(S))123trimethoxy9oxo10((4oxo4(4((234trimethoxyphenyl)methyl)piperazin1yl)butyl)amino)67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1574353620
75492410
COc1c(OC)ccc(c1OC)CN1CCN(CC1)C(=O)CCCNc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C
InChI=1SC39H50N4O9c124(44)41291310252133(483)38(516)39(527)35(25)27121430(31(45)2228(27)29)40168934(46)43191742(182043)2326111532(472)37(505)36(26)494h11121415212229H81013162023H217H3(H4045)(H4144)t29m0s1
N((7S)123trimethoxy9oxo10((4oxo4(4(234trimethoxybenzyl)piperazin1yl)butyl)amino)5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000150653791
ZINC150653791
Check stock
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Check stock on Vitas-MAvailable files
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