input word = C00001817

Metabolite InformationStructural formula
Name Berbamine
(+)-Berbamine
d-Berbamine
Formula C37H40N2O6
Mw 608.28863702
CAS RN 478-61-5
C_ID C00001817 ,
InChIKey DFOCUWZXJBAUSQ-ZTMACLEXNA-N
InChICode InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-31-18-23(8-11-30(31)40)17-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3/t28-,29+/m0/s1
SMILES COc1cc2c3cc1Oc1c(OC)c(OC)cc4c1[C@@H](Cc1ccc(O)c(c1)Oc1ccc(cc1)C[C@@H]3N(C)CC2)N(C)CC4
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr L-Phe
Organism
Kingdom Family Species Reference
PlantaeBerberidaceaeBerberis aemulans Ref.
PlantaeBerberidaceaeBerberis amurensis Ref.
PlantaeBerberidaceaeBerberis aristata Ref.
PlantaeBerberidaceaeBerberis brandisiana Ref.
PlantaeBerberidaceaeBerberis candidula Ref.
PlantaeBerberidaceaeBerberis diaphana Ref.
PlantaeBerberidaceaeBerberis dubia Ref.
PlantaeBerberidaceaeBerberis glauca Ref.
PlantaeBerberidaceaeBerberis heterobotrys Ref.
PlantaeBerberidaceaeBerberis libanotica Ref.
PlantaeBerberidaceaeBerberis oblonga Ref.
PlantaeBerberidaceaeBerberis poirettii Ref.
PlantaeBerberidaceaeBerberis potaninii Ref.
PlantaeBerberidaceaeBerberis sibirica Ref.
PlantaeBerberidaceaeBerberis thunbergii Ref.
PlantaeBerberidaceaeBerberis turcomanica Ref.
PlantaeBerberidaceaeBerberis vulgaris Ref.
PlantaeBerberidaceaeMahonia aquifolium Ref.
PlantaeBerberidaceaeMahonia fortunei Ref.
PlantaeBerberidaceaeMahonia japonica Ref.
PlantaeMenispermaceaeMenispermum dauricum Ref.
PlantaeMenispermaceaePycnarrhena manillensis Ref.
PlantaeMenispermaceaeStephania cepharantha Ref.
PlantaeMenispermaceaeStephania sasakii Ref.
PlantaeMonimiaceaeAtherosperma moschatum Ref.
PlantaeRanunculaceaeThalictrum atriplex Ref.
PlantaeRanunculaceaeThalictrum faberi Ref.
PlantaeRanunculaceaeThalictrum foliolosum Ref.
PlantaeRanunculaceaeThalictrum glandulosissimum Ref.
PlantaeRanunculaceaeThalictrum microgynum Ref.
PlantaeRanunculaceaeThalictrum petaloidum Ref.
PlantaeRanunculaceaeThalictrum simplex var.brevipes Ref.
PlantaeRanunculaceaeThalictrum thunbergii Ref.
--Rhizoma coptidis Ref.
--Rhizoma coptis Ref.
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OrganismBerberis vulgaris
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21