input word = C00028976

Metabolite InformationStructural formula
Name Scutianine J
Formula C34H40N4O6
Mw 600.29478504
CAS RN 163136-11-6
C_ID C00028976 ,
InChIKey OXPSAWGMQIPSCA-FMQUCBEENA-N
InChICode InChI=1S/C34H40N4O6/c1-21(2)31-27(37-34(43)28(38(3)4)30(40)24-13-9-6-10-14-24)33(42)36-26(29(39)23-11-7-5-8-12-23)32(41)35-20-19-22-15-17-25(44-31)18-16-22/h5-21,26-31,39-40H,1-4H3,(H,35,41)(H,36,42)(H,37,43)/b20-19+/t26-,27+,28+,29-,30+,31-/m1/s1
SMILES c1cc2/C=C/NC(=O)[C@H](NC(=O)[C@H]([C@H](Oc1cc2)C(C)C)NC(=O)[C@H]([C@H](c1ccccc1)O)N(C)C)[C@H](O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Asp L-Phe L-His
Organism
Kingdom Family Species Reference
PlantaeRhamnaceaeScutia buxifolia Ref.
zoom in