CHEBI:169358 - Palmidin C

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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 Palmidin C
ChEBI ID CHEBI:169358
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C30H22O7
Net Charge 0
Average Mass 494.499
Monoisotopic Mass 494.13655
InChI InChI=1S/C30H22O7/c1-12-6-16-23(15-4-3-5-19(32)25(15)29(36)26(16)20(33)8-12)24-17-7-13(2)9-21(34)27(17)30(37)28-18(24)10-14(31)11-22(28)35/h3-11,23-24,31-35H,1-2H3
InChIKey VUUFXTUVVIEIMH-UHFFFAOYSA-N
SMILES O=C1C2=C(C(C3C4=C(C(=O)C5=C3C=CC=C5O)C(O)=CC(=C4)C)C6=C1C(O)=CC(O)=C6)C=C(C=C2O)C
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
ChEBI Ontology
Outgoing Palmidin C (CHEBI:169358) is a anthracenes (CHEBI:46955)
IUPAC Name
10-(4,5-dihydroxy-2-methyl-10-oxo-9H-anthracen-9-yl)-1,3,8-trihydroxy-6-methyl-10H-anthracen-9-one
Manual Xrefs Databases
4478487 ChemSpider
HMDB0033864 HMDB
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Registry Number Type Source
17177-86-5 CAS Registry Number ChemIDplus