CHEBI:181910 - [5-Hydroxy-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-2-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate

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ChEBI Name [5-Hydroxy-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-2-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate
ChEBI ID CHEBI:181910
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C24H28O12
Net Charge 0
Average Mass 508.476
Monoisotopic Mass 508.15808
InChI InChI=1S/C24H28O12/c25-9-14-18(29)19(30)20(31)23(34-14)35-22-16-13(7-8-32-22)17(28)21-24(16,36-21)10-33-15(27)6-3-11-1-4-12(26)5-2-11/h1-8,13-14,16-23,25-26,28-31H,9-10H2
InChIKey MVTLXFDHKDVAIC-UHFFFAOYSA-N
SMILES O1C2(C1C(O)C3C2C(OC=C3)OC4OC(C(O)C(O)C4O)CO)COC(=O)C=CC5=CC=C(O)C=C5
ChEBI Ontology
Outgoing [5-Hydroxy-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-2-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate (CHEBI:181910) is a cinnamate ester (CHEBI:36087)
IUPAC Name
[5-hydroxy-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-2-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate