Vitas-M small molecule compound

methyl N-(2-{[6-ethyl-3-(4-methyl-1,3-thiazol-2-yl)-4-oxo-4H-chromen-7-yl]oxy}propanoyl)-D-tryptophanate

Catalog ID
STL525605
SMILES COC(=O)[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)C(Oc1cc2occ(c(=O)c2cc1CC)c1scc(n1)C)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 C30H29N3O6S MW 559.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O6S/c1-5-18-10-21-26(38-14-22(27(21)34)29-32-16(2)15-40-29)12-25(18)39-17(3)28(35)33-24(30(36)37-4)11-19-13-31-23-9-7-6-8-20(19)23/h6-10,12-15,17,24,31H,5,11H2,1-4H3,(H,33,35)/t17?,24-/m1/s1
InChIKey
BJOXTKUHYSNSTC-FZYLFJGDSA-N
Synonyms
1214632-99-1
(2R)methyl2(2((6ethyl3(4methylthiazol2yl)4oxo4Hchromen7yl)oxy)propanamido)3(1Hindol3yl)propanoate
1214632991
16395421
COC(=O)(C@@H)(Cc1c(nH)c2c1cccc2)NC(=O)C(Oc1cc2occ(c(=O)c2cc1CC)c1scc(n1)C)C
InChI=1SC30H29N3O6Sc1518102126(381422(27(21)34)293216(2)154029)1225(18)3917(3)28(35)3324(30(36)374)1119133123976820(19)23h6101215172431H511H214H3(H3335)t17?24m1s1
methyl(2~(R))2(2(6ethyl3(4methyl13thiazol2yl)4oxochromen7yl)oxypropanoylamino)3(1~(H)indol3yl)propanoate
methylN(2((6ethyl3(4methyl13thiazol2yl)4oxo4Hchromen7yl)oxy)propanoyl)Dtryptophanate
MFCD01083026
ZINC000002097347
ZINC000002097349

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.