input word = C00025531

Metabolite InformationStructural formula
Name Semperviramidine
(+)-Semperviramidine
Formula C35H52N2O4
Mw 564.39270816
CAS RN 116965-58-3
C_ID C00025531 ,
InChIKey PZUXCVGZGCVETM-NWJRNKATNA-N
InChICode InChI=1S/C35H52N2O4/c1-22(37(6)7)29-25(41-23(2)39)19-33(5)27-14-13-26-31(3,21-38)28(36-30(40)24-11-9-8-10-12-24)15-16-34(26)20-35(27,34)18-17-32(29,33)4/h8-12,22,25-29,38H,13-21H2,1-7H3,(H,36,40)/t22-,25+,26-,27-,28-,29-,31+,32+,33-,34-,35+/m0/s1
SMILES C1[C@@H]([C@@]([C@H]2[C@@]3(C1)[C@@]1([C@@H](CC2)[C@]2([C@](CC1)([C@H]([C@@H](C2)OC(=O)C)[C@@H](N(C)C)C)C)C)C3)(CO)C)NC(=O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-His
Organism
Kingdom Family Species Reference
PlantaeBuxaceaeBuxus sempervirens Ref.
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OrganismBuxus sempervirens
ReferenceAtta-ur-Rahman,Phytochem.,(in press)