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-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)hexanamide

Catalog ID
STL540271
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCCCC(=O)NCc2nnc3n2cccc3)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 C34H40N6O6 MW 628.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H40N6O6/c1-21(41)37-25-14-12-22-18-28(44-2)33(45-3)34(46-4)32(22)23-13-15-26(27(42)19-24(23)25)35-16-8-5-6-11-31(43)36-20-30-39-38-29-10-7-9-17-40(29)30/h7,9-10,13,15,17-19,25H,5-6,8,11-12,14,16,20H2,1-4H3,(H,35,42)(H,36,43)(H,37,41)/t25-/m0/s
InChIKey
ZNUCLFJSFLHNEP-VWLOTQADSA-N
Synonyms
1574377-32-4
(S)N((124)triazolo(43a)pyridin3ylmethyl)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)hexanamide
1574377324
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)((124)triazolo(43a)pyridin3ylmethyl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((124)triazolo(43a)pyridin3ylmethyl)hexanamide
75491110
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCCCC(=O)NCc2nnc3n2cccc3)NC(=O)C)cc(c1OC)OC
InChI=1SC34H40N6O6c121(41)37251412221828(442)33(453)34(464)32(22)23131526(27(42)1924(23)25)35168561131(43)36203039382910791740(29)30h79101315171925H5681112141620H214H3(H3542)(H3643)(H3741)t25m0s1
ZINC000108447715
ZINC108447715

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Available files

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