Vitas-M small molecule compound

N-[(6-chloro-7-methoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-L-isoleucine

Catalog ID
STL530030
SMILES CC[C@H]([C@@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)OC)Cl)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 C19H22ClNO6 MW 395.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClNO6/c1-5-9(2)17(18(23)24)21-16(22)7-12-10(3)11-6-13(20)15(26-4)8-14(11)27-19(12)25/h6,8-9,17H,5,7H2,1-4H3,(H,21,22)(H,23,24)/t9-,17+/m1/s1
InChIKey
JXQBCWZYYPNBGQ-XLFHBGCDSA-N
Synonyms
956047-97-5
(2~(S)3~(R))2((2(6chloro7methoxy4methyl2oxochromen3yl)acetyl)amino)3methylpentanoicacid
(2S3R)2((2(6CHLORO7METHOXY4METHYL2OXOCHROMEN3YL)ACETYL)AMINO)3METHYLPENTANOICACID
(2S3R)2(2(6chloro7methoxy4methyl2oxo2Hchromen3yl)acetamido)3methylpentanoicacid
1777692
956047975
CC(C@H)((C@@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)OC)Cl)C
InChI=1SC19H22ClNO6c159(2)17(18(23)24)2116(22)71210(3)11613(20)15(264)814(11)2719(12)25h68917H57H214H3(H2122)(H2324)t917+m1s1
MFCD05676245
N((6chloro7methoxy4methyl2oxo2Hchromen3yl)acetyl)Lisoleucine
ZINC000002122871
ZINC2122871

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Available files

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