CHEBI:203469 - (+)-epicytoskyrin

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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 (+)-epicytoskyrin
ChEBI ID CHEBI:203469
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C30H22O12
Net Charge 0
Average Mass 574.494
Monoisotopic Mass 574.11113
InChI InChI=1S/C30H22O12/c1-41-7-3-9-13(11(31)5-7)21(33)17-25(37)20-23(35)15-16-24(36)19(29(15,17)27(9)39)26(38)18-22(34)14-10(28(40)30(16,18)20)4-8(42-2)6-12(14)32/h3-6,15-16,19-20,23-24,31-36H,1-2H3/t15-,16-,19+,20+,23-,24-,29+,30+/m0/s1
InChIKey XCVVPOULTLHKLV-PUTAFCBNSA-N
SMILES O=C1C2=C(C(O)=C3[C@]14[C@H]5C(=O)C6=C(O)C=7C(O)=CC(=CC7C([C@@]86[C@@H]([C@H]4[C@H](O)[C@@H]8C3=O)[C@@H]5O)=O)OC)C(O)=CC(=C2)OC
Metabolite of Species Details
Diaporthespecies (NCBI:txid1756133) See: PubMed
ChEBI Ontology
Outgoing (+)-epicytoskyrin (CHEBI:203469) is a naphthols (CHEBI:25392)
IUPAC Name
(1R,2S,13R,14S,15R,16R,17S,28S)-8,10,14,23,25,28-hexahydroxy-6,21-dimethoxyoctacyclo[14.11.1.02,11.02,15.04,9.013,17.017,26.019,24]octacosa-4(9),5,7,10,19(24),20,22,25-octaene-3,12,18,27-tetrone