input word = C00055717

Metabolite InformationStructural formula
Name aristoloin II
Formula C36H41NO7
Mw 599.28830267
CAS RN 611211-59-7
C_ID C00055717
InChIKey NSKGDTVEJJFLRM-JAZARSDYSA-N
InChICode InChI=1S/C36H41NO7/c1-33(2)12-6-13-34(3)27(33)11-14-35-17-22(9-10-28(34)35)36(39,18-35)19-42-32(38)24-16-26-31(44-20-43-26)30-23-8-5-4-7-21(23)15-25(29(24)30)37(40)41/h4-5,7-8,15-16,22,27-28,39H,6,9-14,17-20H2,1-3H3/t22-,27-,28+,34-,35+,36+/m1/s1
SMILES CC1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@@](O)(COC(=O)c1cc2c(c4c1c([N+](=O)[O-])cc1ccccc14)OCO2)C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAristolochiaceaeAristolochia pubescens Ref.
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