Vitas-M small molecule compound

4-hydroxy-3-pentanoyl-2H-chromen-2-one

Catalog ID
STK136075
SMILES CCCCC(=O)c1c(=O)oc2c(c1O)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 C14H14O4 MW 246.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14O4/c1-2-3-7-10(15)12-13(16)9-6-4-5-8-11(9)18-14(12)17/h4-6,8,16H,2-3,7H2,1H3
InChIKey
UOUQUFVBCJNHNY-UHFFFAOYSA-N
Synonyms
36953-87-4
2HYDROXY3PENTANOYLCHROMEN4ONE
4HYDROXY3PENTANOYL2HCHROMEN2ONE
4HYDROXY3PENTANOYLCHROMEN2ONE
4HYDROXY3VALERYLCOUMARIN
CCCCC(=O)C1=C(C2=CC=CC=C2OC1=O)O
Registry IDs
MFCD05026278
ZINC000003957296
ZINC3957296

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Available files

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