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CHEBI:758785 - ab-001

Default Structure
ChEBI IDCHEBI:758785
ChEBI Nameab-001
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC23H24O6
Net Charge0
Average Mass396.439
Monoisotopic Mass396.15729
SMILESCOc1cc(/C=C/C(=O)/C=C/C=C/c2cc(OC)c(O)c(OC)c2)cc(OC)c1
InChIInChI=1S/C23H24O6/c1-26-19-11-17(12-20(15-19)27-2)9-10-18(24)8-6-5-7-16-13-21(28-3)23(25)22(14-16)29-4/h5-15,25H,1-4H3/b7-5+,8-6+,10-9+
InChIKeyLJSMCOGLALRQKD-BISOHRNISA-N
Roles Classification
Biological Roles:
analgesic  An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application:
analgesic  An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.
ChEBI Ontology
Outgoing Relation(s)
ab-001 (CHEBI:758785) has role analgesic (CHEBI:35480)
ab-001 (CHEBI:758785) is a diarylheptanoid (CHEBI:78802)
Synonyms  Source
Ab-001ChEMBL
AB001ChEMBL