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CHEBI:209079 - Austrocolorin A1

ChEBI IDCHEBI:209079
ChEBI NameAustrocolorin A1
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SubmitterMetaboLights
DownloadsMolfile
FormulaC34H34O10
Net Charge0
Average Mass602.636
Monoisotopic Mass602.21520
SMILESCOc1cc(OC)c2c(O)c3c(c(-c4c5c(c(O)c6c(OC)cc(OC)cc46)C(=O)C[C@@](C)(O)C5)c2c1)C[C@](C)(O)CC3=O
InChIInChI=1S/C34H34O10/c1-33(39)11-19-25(17-7-15(41-3)9-23(43-5)29(17)31(37)27(19)21(35)13-33)26-18-8-16(42-4)10-24(44-6)30(18)32(38)28-20(26)12-34(2,40)14-22(28)36/h7-10,37-40H,11-14H2,1-6H3/t33-,34-/m0/s1
InChIKeyVVWGQJAVEGHWEP-HEVIKAOCSA-N
Species of MetaboliteComponentSourceComments
Dermocybespecies (ncbitaxon:2506242) - PubMed (15110682)
ChEBI Ontology
Outgoing Relation(s)
Austrocolorin A1 (CHEBI:209079) is a lignan (CHEBI:25036)
IUPAC Name 
(3S)-10-[(2S)-2,10-dihydroxy-5,7-dimethoxy-2-methyl-4-oxo-1,3-dihydroanthracen-9-yl]-3,9-dihydroxy-6,8-dimethoxy-3-methyl-2,4-dihydroanthracen-1-one
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