Vitas-M small molecule compound

N-[(Z)-(2,4-dioxo-2H-chromen-3(4H)-ylidene)methyl]alanine

Catalog ID
STK192000
SMILES CC(C(=O)O)N/C=C/1\C(=O)Oc2c(C1=O)cccc2

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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 C13H11NO5 MW 261.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11NO5/c1-7(12(16)17)14-6-9-11(15)8-4-2-3-5-10(8)19-13(9)18/h2-7,14H,1H3,(H,16,17)/b9-6-
InChIKey
SHFCGMOIWFRGKS-TWGQIWQCSA-N
Synonyms

2(((Z)(24dioxochromen3ylidene)methyl)amino)propanoicacid
CC(C(=O)O)NC=C1C(=O)C2=CC=CC=C2OC1=O
CC(C(=O)O)NC=C1C(=O)Oc2c(C1=O)cccc2
InChI=1SC13H11NO5c17(12(16)17)146911(15)8423510(8)1913(9)18h2714H1H3(H1617)b96
MFCD08671516
N((Z)(24DIOXO2HCHROMEN3(4H)YLIDENE)METHYL)ALANINE
ZINC000100916442
ZINC000100916445

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Available files

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