input word = C00027237

Metabolite InformationStructural formula
Name Scutianine B
Formula C34H40N4O4
Mw 568.30495579
CAS RN 35467-41-5
C_ID C00027237 ,
InChIKey PEINZJYANJZEKK-FMQUCBEENA-N
InChICode InChI=1S/C34H40N4O4/c1-23(2)31-30(37-33(40)29(38(3)4)22-26-13-9-6-10-14-26)34(41)36-28(21-25-11-7-5-8-12-25)32(39)35-20-19-24-15-17-27(42-31)18-16-24/h5-20,23,28-31H,21-22H2,1-4H3,(H,35,39)(H,36,41)(H,37,40)/b20-19+/t28-,29+,30+,31+/m0/s1
SMILES c1cc2ccc1O[C@@H]([C@H](C(=O)N[C@H](C(=O)N/C=C\2)Cc1ccccc1)NC(=O)[C@H](N(C)C)Cc1ccccc1)C(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Asp L-Phe L-His
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeMelochia chamaedrys Ref.
PlantaeMalvaceaeWaltheria douradinha Ref.
PlantaeRhamnaceaeCondalia buxifolia Ref.
PlantaeRhamnaceaeScutia buxifolia Ref.
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OrganismWaltheria douradinha
ReferenceMorel,Phytochem.,51,(1999),473