CHEBI:7018 - mulberrofuran C

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ChEBI Name mulberrofuran C
ChEBI ID CHEBI:7018
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C34H28O9
Net Charge 0
Average Mass 580.582
Monoisotopic Mass 580.17333
InChI InChI=1S/C34H28O9/c1-16-8-24(22-6-4-19(35)13-26(22)38)32(34(42)23-7-5-20(36)14-27(23)39)25(9-16)33-28(40)10-18(11-29(33)41)30-12-17-2-3-21(37)15-31(17)43-30/h2-7,9-15,24-25,32,35-41H,8H2,1H3/t24-,25+,32-/m0/s1
InChIKey WTGKDESIYCVAOP-UNTHUGQZSA-N
SMILES CC1=C[C@H]([C@H]([C@@H](C1)c1ccc(O)cc1O)C(=O)c1ccc(O)cc1O)c1c(O)cc(cc1O)-c1cc2ccc(O)cc2o1
ChEBI Ontology
Outgoing mulberrofuran C (CHEBI:7018) is a 1-benzofurans (CHEBI:38830)
Synonym Source
Mulberrofuran C KEGG COMPOUND
Manual Xrefs Databases
C00002405 KNApSAcK
C08928 KEGG COMPOUND
View more database links
Registry Number Type Source
77996-04-4 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014