input word = C00032733

Metabolite InformationStructural formula
Name Aristoloterpenate II
(-)-Aristoloterpenate II
Formula C31H29NO7
Mw 527.19440229
CAS RN 222403-62-5
C_ID C00032733 ,
InChIKey XJBILGKCOVAJTM-OPBXMQJPNA-N
InChICode InChI=1S/C31H29NO7/c1-19-7-5-9-20(2)13-23(14-21(17-33)10-6-8-19)39-31(34)25-16-27-30(38-18-37-27)29-24-12-4-3-11-22(24)15-26(28(25)29)32(35)36/h3-4,8-9,11-12,14-17,23H,5-7,10,13,18H2,1-2H3/b19-8-,20-9+,21-14-/t23-/m1/s1
SMILES C/C1=C/CC/C(C=O)=C/[C@H](OC(=O)c2cc3c(c4c2c([N+](=O)[O-])cc2ccccc24)OCO3)C/C(C)=C/CC1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeAristolochiaceaeAristolochia heterophylla Hemsl Ref.
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