input word = C00001319

Metabolite InformationStructural formula
Name Pinolidoxin
Formula C18H26O6
Mw 338.17293856
CAS RN 152985-39-2
C_ID C00001319 ,
InChIKey TXPRZPDVUZCNLB-YECGNMMBNA-N
InChICode InChI=1S/C18H26O6/c1-3-5-6-12-16(20)23-15-11-8-7-10-13(19)17(21)14(9-4-2)24-18(15)22/h3,5-7,10,12-15,17,19,21H,4,8-9,11H2,1-2H3/b5-3+,10-7+,12-6+/t13-,14+,15+,17-/m0/s1
SMILES [C@H]1([C@@H]([C@H](OC(=O)[C@@H](CC/C=C/1)OC(=O)/C=C\C=C\C)CCC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaePisum sativum Ref.
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