input word = C00036762

Metabolite InformationStructural formula
Name Aristolin
(-)-Aristolin
Formula C37H43NO8
Mw 629.29886736
CAS RN 1398-05-6
C_ID C00036762 ,
InChIKey KFVNSGSGMMBVOZ-MPPGKIRXNA-N
InChICode InChI=1S/C37H43NO8/c1-34(2)12-6-13-35(3)28(34)11-14-36-17-21(9-10-29(35)36)37(18-36,19-39)46-33(40)24-16-27-32(45-20-44-27)31-22-7-5-8-26(43-4)23(22)15-25(30(24)31)38(41)42/h5,7-8,15-16,21,28-29,39H,6,9-14,17-20H2,1-4H3/t21-,28-,29+,35-,36+,37+/m1/s1
SMILES c12c3c(c(cc1OCO2)C(=O)O[C@]1([C@@H]2CC[C@@H]4[C@](C2)(CC[C@H]2[C@]4(CCCC2(C)C)C)C1)CO)c(cc1c3cccc1OC)[N+](=O)[O-]
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Indole-3 GGPP
Organism
Kingdom Family Species Reference
PlantaeAristolochiaceaeAristolochia elegans Ref.
PlantaeAristolochiaceaeAristolochia pubescens Ref.
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