Vitas-M small molecule compound

8-hydroxy-6-(4-hydroxy-3-methoxyphenyl)-1,3-dimethyl-4H-cyclohepta[c]furan-4-one

Catalog ID
STK856951
SMILES COc1cc(ccc1O)c1cc(=O)c2c(c(c1)O)c(oc2C)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 C18H16O5 MW 312.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16O5/c1-9-17-14(20)6-12(7-15(21)18(17)10(2)23-9)11-4-5-13(19)16(8-11)22-3/h4-8,19-20H,1-3H3
InChIKey
ZZCKKCQRKVKLRP-UHFFFAOYSA-N
Synonyms
374711-43-0
374711430
4HYDROXY6(4HYDROXY3METHOXYPHENYL)13DIMETHYLCYCLOHEPTA(C)FURAN8ONE
8hydroxy6(4hydroxy3methoxyphenyl)13dimethyl4Hcyclohepta(c)furan4one
8HYDROXY6(4HYDROXY3METHOXYPHENYL)13DIMETHYLCYCLOHEPTA(C)FURAN4ONE
CC1=C2C(=CC(=CC(=O)C2=C(O1)C)C3=CC(=C(C=C3)O)OC)O
InChI=1SC18H16O5c191714(20)612(715(21)18(17)10(2)239)114513(19)16(811)223h481920H13H3
MFCD02057294
ZINC000000112050
ZINC00112050
ZINC112050

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Available files

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