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CHEBI:81529 - Norbinaltorphimine

ChEBI IDCHEBI:81529
ChEBI NameNorbinaltorphimine
Stars
DownloadsMolfile
FormulaC40H43N3O6
Net Charge0
Average Mass661.799
Monoisotopic Mass661.31519
SMILESOc1ccc2c3c1O[C@H]1c4nc5c(c4C[C@@]4(O)[C@@H](C2)N(CC2CC2)CC[C@]314)C[C@@]1(O)[C@H]2Cc3ccc(O)c4c3[C@@]1(CCN2CC1CC1)[C@H]5O4
InChIInChI=1S/C40H43N3O6/c44-25-7-5-21-13-27-39(46)15-23-24-16-40(47)28-14-22-6-8-26(45)34-30(22)38(40,10-12-43(28)18-20-3-4-20)36(49-34)32(24)41-31(23)35-37(39,29(21)33(25)48-35)9-11-42(27)17-19-1-2-19/h5-8,19-20,27-28,35-36,41,44-47H,1-4,9-18H2/t27-,28-,35+,36+,37+,38+,39-,40-/m1/s1
InChIKeyAPSUXPSYBJVPPS-YAUKWVCOSA-N
ChEBI Ontology
Outgoing Relation(s)
Norbinaltorphimine (CHEBI:81529) is a isoquinolines (CHEBI:24922)
Synonym  Source
norBNIKEGG COMPOUND
Manual XrefsDatabases
C18130KEGG COMPOUND
Registry NumbersSources
CAS:105618-26-6KEGG COMPOUND