input word = C00001895

Metabolite InformationStructural formula
Name Obaberine
Formula C38H42N2O6
Mw 622.30428709
CAS RN 1263-80-5
C_ID C00001895 ,
InChIKey FBCXFKWMGIWMJQ-SPFVONBBNA-N
InChICode InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)18-24-9-12-31(41-3)33(19-24)45-27-10-7-23(8-11-27)17-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3/t29-,30+/m1/s1
SMILES c12c3c(c(c(c1)OC)OC)Oc1c(cc4c(c1)[C@H](N(CC4)C)Cc1ccc(c(c1)Oc1ccc(cc1)C[C@@H]3N(CC2)C)OC)OC
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeBerberidaceaeBerberis baluchistanica Ref.
PlantaeBerberidaceaeBerberis heterobotrys Ref.
PlantaeBerberidaceaeBerberis spp. Ref.
PlantaeBerberidaceaeBerberis tschonoskiana Ref.
PlantaeBerberidaceaeBerberis vulgaris Ref.
PlantaeBerberidaceaeMahonia repens Ref.
PlantaeLauraceaeDehaasia triandra Ref.
PlantaeMenispermaceaeAlbertisia papuana Ref.
PlantaeMenispermaceaeStephania cepharantha Ref.
PlantaeMenispermaceaeStephania erecta Ref.
PlantaeRanunculaceaeThalictrum incidum Ref.
PlantaeRanunculaceaeThalictrum lucidum Ref.
PlantaeRanunculaceaeThalictrum minus Ref.
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OrganismStephania cepharantha
ReferenceKashiwaba,Chem.Pharm.Bull.,45,(1997),470