Fragransol A (CHEBI:175816)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Fragransol A

ChEBI ID	CHEBI:175816

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H26O6

Net Charge

Average Mass

374.433

Monoisotopic Mass

374.17294

InChI

InChI=1S/C21H26O6/c1-11-15-8-14(20(26-5)12(2)22)10-18(25-4)21(15)27-19(11)13-6-7-16(23)17(9-13)24-3/h6-12,19-20,22-23H,1-5H3

InChIKey

DHRVKFSLKMAPEL-UHFFFAOYSA-N

SMILES

O1C(C(C2=C1C(OC)=CC(=C2)C(OC)C(O)C)C)C3=CC(OC)=C(O)C=C3

ChEBI Ontology
Outgoing	Fragransol A (CHEBI:175816) is a benzofurans (CHEBI:35259)

IUPAC Name

4-[5-(2-hydroxy-1-methoxypropyl)-7-methoxy-3-methyl-2,3-dihydro-1-benzouran-2-yl]-2-methoxyphenol