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CHEBI:224852 - Alterporriol T

ChEBI IDCHEBI:224852
ChEBI NameAlterporriol T
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SubmitterMetaboLights
DownloadsMolfile
FormulaC32H30O13
Net Charge0
Average Mass622.579
Monoisotopic Mass622.16864
SMILESCOc1cc2c(c(O)c1-c1c(OC)cc(O)c3c1C(=O)C1=C(C[C@@H](O)[C@@](C)(O)[C@@H]1O)C3=O)C(=O)C1=C(C[C@](C)(O)[C@H](O)C1)C2=O
InChIInChI=1S/C32H30O13/c1-31(42)9-13-10(6-17(31)34)26(37)19-11(25(13)36)5-15(44-3)23(28(19)39)22-16(45-4)8-14(33)21-24(22)29(40)20-12(27(21)38)7-18(35)32(2,43)30(20)41/h5,8,17-18,30,33-35,39,41-43H,6-7,9H2,1-4H3/t17-,18-,30-,31+,32-/m1/s1
InChIKeyIEFTVHHVCNGFFB-CYFFLJPJSA-N
Species of MetaboliteComponentSourceComments
Stemphyliumspecies 33231 (ncbitaxon:1418481) - PubMed (25136754)
ChEBI Ontology
Outgoing Relation(s)
Alterporriol T (CHEBI:224852) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
(2R,3R,4R)-2,3,4,8-tetrahydroxy-6-methoxy-3-methyl-5-[(6S,7R)-1,6,7-trihydroxy-3-methoxy-6-methyl-9,10-dioxo-7,8-dihydro-5H-anthracen-2-yl]-2,4-dihydro-1H-anthracene-9,10-dione
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