Vitas-M small molecule compound

6-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[2-(dimethylamino)ethyl]hexanamide

Catalog ID
STL548391
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCCCC(=O)NCCN(C)C)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 C31H44N4O6 MW 568.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H44N4O6/c1-20(36)34-24-13-11-21-18-27(39-4)30(40-5)31(41-6)29(21)22-12-14-25(26(37)19-23(22)24)32-15-9-7-8-10-28(38)33-16-17-35(2)3/h12,14,18-19,24H,7-11,13,15-17H2,1-6H3,(H,32,37)(H,33,38)(H,34,36)/t24-/m0/s1
InChIKey
MXUIRDGANIEINE-DEOSSOPVSA-N
Synonyms

(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(dimethylamino)ethyl)hexanamide
110208152
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(dimethylamino)ethyl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(dimethylamino)ethyl)hexanamide
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCCCC(=O)NCCN(C)C)NC(=O)C)cc(c1OC)OC
InChI=1SC31H44N4O6c120(36)34241311211827(394)30(405)31(416)29(21)22121425(26(37)1923(22)24)32159781028(38)33161735(2)3h1214181924H711131517H216H3(H3237)(H3338)(H3436)t24m0s1
ZINC000253410196
ZINC253410196

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Available files

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