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CHEBI:141916 - Isosungucine

ChEBI IDCHEBI:141916
ChEBI NameIsosungucine
Stars
Last Modified30 August 2018
Submittermwilliams
DownloadsMolfile
FormulaC42H42N4O2
Net Charge0
Average Mass634.824
Monoisotopic Mass634.33078
SMILES[H][C@]12C=CC(=O)N3c4ccccc4[C@@]4(C[C@]([H])(C5C=C6[C@@]7([H])C[C@]8([H])N(CC[C@@]89c8ccccc8N(C5=O)[C@@]69[H])C/C7=C/C)N5C/C(=C/C)[C@]1([H])C[C@]54[H])[C@@]32[H]
InChIInChI=1S/C42H42N4O2/c1-3-23-21-43-16-15-41-30-9-5-8-12-33(30)46-39(41)28(27(23)18-35(41)43)17-29(40(46)48)34-20-42-31-10-6-7-11-32(31)45-37(47)14-13-25(38(42)45)26-19-36(42)44(34)22-24(26)4-2/h3-14,17,25-27,29,34-36,38-39H,15-16,18-22H2,1-2H3/b23-3-,24-4-/t25-,26-,27-,29?,34+,35-,36-,38-,39-,41+,42+/m0/s1
InChIKeyCLTKURJLSGQYAV-MGVOARHGSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Isosungucine (CHEBI:141916) is a monoterpenoid indole alkaloid (CHEBI:65323)