CHEBI:199334 - Alterporriol W

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ChEBI Name Alterporriol W
ChEBI ID CHEBI:199334
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C32H22O11
Net Charge 0
Average Mass 582.517
Monoisotopic Mass 582.11621
InChI InChI=1S/C32H22O11/c1-10-5-14-21(31(40)19-15(29(14)38)6-12(42-3)8-17(19)33)22(26(10)35)23-24-25(28(37)11(2)27(23)36)30(39)16-7-13(43-4)9-18(34)20(16)32(24)41/h5-9,33-37H,1-4H3
InChIKey PDXBHDQQJVXFFT-UHFFFAOYSA-N
SMILES O=C1C2=C(C(=O)C=3C1=C(O)C=C(OC)C3)C(O)=C(C)C(=C2C4=C(O)C(=CC5=C4C(=O)C6=C(O)C=C(OC)C=C6C5=O)C)O
Metabolite of Species Details
Stemphyliumspecies 33231 (NCBI:txid1418481) See: PubMed
Alternariaspecies XZSBG-1 (NCBI:txid870234) See: PubMed
ChEBI Ontology
Outgoing Alterporriol W (CHEBI:199334) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Names
2,8-dihydroxy-6-methoxy-3-methyl-1-[(6R,7R,8R)-4,6,7,8-tetrahydroxy-2-methoxy-7-methyl-9,10-dioxo-6,8-dihydro-5H-anthracen-1-yl]anthracene-9,10-dione
4-(2,8-dihydroxy-6-methoxy-3-methyl-9,10-dioxoanthracen-1-yl)-1,3,5-trihydroxy-7-methoxy-2-methylanthracene-9,10-dione
Manual Xrefs Databases
34981542 ChemSpider
78435579 ChemSpider
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