CHEBI:9647 - Trachelogenin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Trachelogenin
ChEBI ID CHEBI:9647
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H24O7
Net Charge 0
Average Mass 388.412
Monoisotopic Mass 388.15220
InChI InChI=1S/C21H24O7/c1-25-17-7-5-13(9-19(17)27-3)8-15-12-28-20(23)21(15,24)11-14-4-6-16(22)18(10-14)26-2/h4-7,9-10,15,22,24H,8,11-12H2,1-3H3/t15-,21-/m0/s1
InChIKey YFVZKLQNMNKWSB-BTYIYWSLSA-N
SMILES COc1cc(C[C@]2(O)[C@@H](Cc3ccc(OC)c(OC)c3)COC2=O)ccc1O
ChEBI Ontology
Outgoing Trachelogenin (CHEBI:9647) is a lignan (CHEBI:25036)
Synonyms Sources
(-)-Trachelogenin KEGG COMPOUND
Trachelogenin KEGG COMPOUND
Manual Xrefs Databases
C00000600 KNApSAcK
C10891 KEGG COMPOUND
View more database links
Registry Number Type Source
34209-69-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014