Vitas-M small molecule compound

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

Catalog ID
STL530713
SMILES CC[C@H]([C@@H](C(=O)O)NC(=O)CNC(=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 C21H25ClN2O7 MW 452.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN2O7/c1-5-10(2)19(20(27)28)24-18(26)9-23-17(25)7-13-11(3)12-6-14(22)16(30-4)8-15(12)31-21(13)29/h6,8,10,19H,5,7,9H2,1-4H3,(H,23,25)(H,24,26)(H,27,28)/t10-,19+/m1/s1
InChIKey
QVDPMQVYJQGFDF-DGIBIBHMSA-N
Synonyms
956050-03-6
(2~(S)3~(R))2((2((2(6chloro7methoxy4methyl2oxochromen3yl)acetyl)amino)acetyl)amino)3methylpentanoicacid
(2S3R)2((2((2(6CHLORO7METHOXY4METHYL2OXOCHROMEN3YL)ACETYL)AMINO)ACETYL)AMINO)3METHYLPENTANOICACID
(2S3R)2(2(2(6chloro7methoxy4methyl2oxo2Hchromen3yl)acetamido)acetamido)3methylpentanoicacid
1773479
956050036
CC(C@H)((C@@H)(C(=O)O)NC(=O)CNC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)OC)Cl)C
InChI=1SC21H25ClN2O7c1510(2)19(20(27)28)2418(26)92317(25)71311(3)12614(22)16(304)815(12)3121(13)29h681019H579H214H3(H2325)(H2426)(H2728)t1019+m1s1
MFCD05674342
N((6chloro7methoxy4methyl2oxo2Hchromen3yl)acetyl)glycylLisoleucine
ZINC000002118720
ZINC2118720

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Available files

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