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CHEBI:4310 - Dalpanin

ChEBI IDCHEBI:4310
ChEBI NameDalpanin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC26H30O12
Net Charge0
Average Mass534.514
Monoisotopic Mass534.17373
SMILES[H]C1(c2cc3c(cc2O)OC([H])(C(C)(C)O)C3)COc2c(c(O)cc(O)c2[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C1=O
InChIInChI=1S/C26H30O12/c1-26(2,35)17-4-9-3-10(12(28)6-15(9)37-17)11-8-36-24-18(20(11)31)13(29)5-14(30)19(24)25-23(34)22(33)21(32)16(7-27)38-25/h3,5-6,11,16-17,21-23,25,27-30,32-35H,4,7-8H2,1-2H3/t11?,16-,17?,21-,22+,23-,25+/m1/s1
InChIKeyFBAPMDCZDDOJRF-VEWMLLAHSA-N
ChEBI Ontology
Outgoing Relation(s)
Dalpanin (CHEBI:4310) is a glycoside (CHEBI:24400)
Dalpanin (CHEBI:4310) is a lignan (CHEBI:25036)
Synonym  Source
DalpaninKEGG COMPOUND
Manual XrefsDatabases
C10416KEGG COMPOUND
C00006180KNApSAcK
Registry NumbersSources
CAS:37376-13-9KEGG COMPOUND