CHEBI:204884 - WS79089A

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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 WS79089A
ChEBI ID CHEBI:204884
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C27H20O9
Net Charge 0
Average Mass 488.448
Monoisotopic Mass 488.11073
InChI InChI=1S/C27H20O9/c1-9-6-10-7-11-8-14(29)18-19(15(11)23(31)16(10)27(34)36-9)25(33)20-21(26(18)35-2)24(32)17-12(22(20)30)4-3-5-13(17)28/h3-5,7,9,14,28-29,31,33H,6,8H2,1-2H3
InChIKey HRWPMELFEHBAIH-UHFFFAOYSA-N
SMILES O=C1OC(CC=2C1=C(O)C=3C4=C(O)C=5C(=O)C6=C(C(O)=CC=C6)C(C5C(=C4C(O)CC3C2)OC)=O)C
Metabolite of Species Details
Streptosporangium (NCBI:txid2000) See: PubMed
ChEBI Ontology
Outgoing WS79089A (CHEBI:204884) is a quinone (CHEBI:36141)
WS79089A (CHEBI:204884) is a tetracenes (CHEBI:51270)
IUPAC Name
3,13,19,26-tetrahydroxy-15-methoxy-7-methyl-6-oxahexacyclo[12.12.0.02,11.04,9.016,25.018,23]hexacosa-1(14),2(11),3,9,15,18(23),19,21,25-nonaene-5,17,24-trione
Manual Xref Database
139333 ChemSpider
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