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-(pyridin-2-ylmethyl)butanamide
Catalog ID
STL542041
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)NCc2ccccn2)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 C31H36N4O6 MW 560.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N4O6/c1-19(36)35-24-12-10-20-16-27(39-2)30(40-3)31(41-4)29(20)22-11-13-25(26(37)17-23(22)24)33-15-7-9-28(38)34-18-21-8-5-6-14-32-21/h5-6,8,11,13-14,16-17,24H,7,9-10,12,15,18H2,1-4H3,(H,33,37)(H,34,38)(H,35,36)/t24-/m0/s1InChIKey
FZYHNOKJUJWBQL-DEOSSOPVSA-NSynonyms
1574353-64-2(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(pyridin2ylmethyl)butanamide
1574353642
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(pyridin2ylmethyl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(pyridin2ylmethyl)butanamide
75491073
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)NCc2ccccn2)NC(=O)C)cc(c1OC)OC
InChI=1SC31H36N4O6c119(36)35241210201627(392)30(403)31(414)29(20)22111325(26(37)1723(22)24)33157928(38)341821856143221h568111314161724H7910121518H214H3(H3337)(H3438)(H3536)t24m0s1
ZINC000108447611
ZINC108447611
Check stock
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Check stock on Vitas-MAvailable files
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