Vitas-M small molecule compound

N-[(5-methoxy-4,7-dimethyl-2-oxo-2H-chromen-3-yl)acetyl]glycyl-L-isoleucine

Catalog ID
STL530481
SMILES CC[C@H]([C@@H](C(=O)O)NC(=O)CNC(=O)Cc1c(=O)oc2c(c1C)c(OC)cc(c2)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 C22H28N2O7 MW 432.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O7/c1-6-12(3)20(21(27)28)24-18(26)10-23-17(25)9-14-13(4)19-15(30-5)7-11(2)8-16(19)31-22(14)29/h7-8,12,20H,6,9-10H2,1-5H3,(H,23,25)(H,24,26)(H,27,28)/t12-,20+/m1/s1
InChIKey
HDOJBLNQEMFBRY-ODXCJYRJSA-N
Synonyms
956043-86-0
(2~(S)3~(R))2((2((2(5methoxy47dimethyl2oxochromen3yl)acetyl)amino)acetyl)amino)3methylpentanoicacid
(2S3R)2((2((2(5METHOXY47DIMETHYL2OXOCHROMEN3YL)ACETYL)AMINO)ACETYL)AMINO)3METHYLPENTANOICACID
(2S3R)2(2(2(5methoxy47dimethyl2oxo2Hchromen3yl)acetamido)acetamido)3methylpentanoicacid
1771491
956043860
CC(C@H)((C@@H)(C(=O)O)NC(=O)CNC(=O)Cc1c(=O)oc2c(c1C)c(OC)cc(c2)C)C
InChI=1SC22H28N2O7c1612(3)20(21(27)28)2418(26)102317(25)91413(4)1915(305)711(2)816(19)3122(14)29h781220H6910H215H3(H2325)(H2426)(H2728)t1220+m1s1
MFCD05673680
N((5methoxy47dimethyl2oxo2Hchromen3yl)acetyl)glycylLisoleucine
ZINC000002116862
ZINC2116862

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Available files

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