CHEBI:210479 - Alterporriol Z2

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Alterporriol Z2
ChEBI ID CHEBI:210479
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C32H26O13
Net Charge 0
Average Mass 618.547
Monoisotopic Mass 618.13734
InChI InChI=1S/C32H26O13/c1-9-5-10-11(6-14(9)33)23(36)17-15(34)7-12(28(44-3)20(17)24(10)37)13-8-16(35)18-21(29(13)45-4)26(39)22-19(25(18)38)27(40)31(42)32(2,43)30(22)41/h5-8,27,30-31,33-35,40-43H,1-4H3/t27-,30-,31+,32-/m0/s1
InChIKey WRLVOFHKFDXIFA-ZKKLFSJWSA-N
SMILES O=C1C2=C(OC)C(C3=C(OC)C=4C(=O)C5=C([C@H](O)[C@@H](O)[C@]([C@H]5O)(O)C)C(C4C(=C3)O)=O)=CC(=C2C(=O)C6=C1C=C(C)C(=C6)O)O
Metabolite of Species Details
Stemphyliumspecies FJJ006 (NCBI:txid1874986) See: PubMed
ChEBI Ontology
Outgoing Alterporriol Z2 (CHEBI:210479) is a hydroxyanthraquinones (CHEBI:37485)