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-methyl-1H-pyrrol-2-yl)methyl]butanamide
Catalog ID
STL543533
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)NCc2cccn2C)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 C31H38N4O6 MW 562.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H38N4O6/c1-19(36)34-24-12-10-20-16-27(39-3)30(40-4)31(41-5)29(20)22-11-13-25(26(37)17-23(22)24)32-14-6-9-28(38)33-18-21-8-7-15-35(21)2/h7-8,11,13,15-17,24H,6,9-10,12,14,18H2,1-5H3,(H,32,37)(H,33,38)(H,34,36)/t24-/m0/s1InChIKey
ZZCOZPYOUCEOBK-DEOSSOPVSA-NSynonyms
1574390-85-4(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((1methyl1Hpyrrol2yl)methyl)butanamide
1574390854
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((1methylpyrrol2yl)methyl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((1methyl1Hpyrrol2yl)methyl)butanamide
75491830
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)NCc2cccn2C)NC(=O)C)cc(c1OC)OC
InChI=1SC31H38N4O6c119(36)34241210201627(393)30(404)31(415)29(20)22111325(26(37)1723(22)24)32146928(38)331821871535(21)2h781113151724H6910121418H215H3(H3237)(H3338)(H3436)t24m0s1
ZINC000108449665
ZINC108449665
Check stock
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Check stock on Vitas-MAvailable files
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