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CHEBI:2544 - albanol A

ChEBI IDCHEBI:2544
ChEBI Namealbanol A
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC34H26O8
Net Charge0
Average Mass562.574
Monoisotopic Mass562.16277
SMILES[H][C@]12[C@]3(c4ccc(O)cc4O)Oc4cc(O)ccc4[C@]1([H])CC(C)=C[C@@]2([H])c1c(O)cc(-c2cc4ccc(O)cc4o2)cc1O3
InChIInChI=1S/C34H26O8/c1-16-8-23-22-6-4-21(37)15-30(22)41-34(25-7-5-19(35)13-26(25)38)33(23)24(9-16)32-27(39)10-18(12-31(32)42-34)28-11-17-2-3-20(36)14-29(17)40-28/h2-7,9-15,23-24,33,35-39H,8H2,1H3/t23-,24-,33-,34+/m0/s1
InChIKeyMJJWBJFYYRAYKU-OPKNDJPNSA-N
ChEBI Ontology
Outgoing Relation(s)
albanol A (CHEBI:2544) is a 1-benzofurans (CHEBI:38830)
albanol A (CHEBI:2544) is a organic heteropentacyclic compound (CHEBI:38164)
Synonyms  Source
Albanol AKEGG COMPOUND
Mulberrofuran GKEGG COMPOUND
Manual XrefsDatabases
C08738KEGG COMPOUND
C00002392KNApSAcK
Registry NumbersSources
CAS:87085-00-5KEGG COMPOUND