Vitas-M small molecule compound

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

Catalog ID
STL464335
SMILES CC[C@@H]([C@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)OC)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 C19H23NO6 MW 361.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO6/c1-5-10(2)17(18(22)23)20-16(21)9-14-11(3)13-7-6-12(25-4)8-15(13)26-19(14)24/h6-8,10,17H,5,9H2,1-4H3,(H,20,21)(H,22,23)/t10-,17+/m0/s1
InChIKey
UTDOUDMTSCJWPW-DYZYQPBXSA-N
Synonyms

(2R3S)2((2(7methoxy4methyl2oxochromen3yl)acetyl)amino)3methylpentanoicacid
(2S3R)2(2(7methoxy4methyl2oxo2Hchromen3yl)acetamido)3methylpentanoicacid
CC(C@@H)((C@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)OC)C
CCC((C@@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)ccc(c2)OC)C
CCC(C)C(C(=O)O)NC(=O)CC1=C(C2=C(C=C(C=C2)OC)OC1=O)C
InChI=1SC19H23NO6c1510(2)17(18(22)23)2016(21)91411(3)137612(254)815(13)2619(14)24h681017H59H214H3(H2021)(H2223)t1017+m0s1
MFCD10041681
N((7methoxy4methyl2oxo2Hchromen3yl)acetyl)Disoleucine
ZINC000011865644
ZINC11865644

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Available files

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