input word = C00020859

Metabolite InformationStructural formula
Name Jamaicolide A
Formula C22H26O8
Mw 418.16276781
CAS RN 102907-28-8
C_ID C00020859 ,
InChIKey PZTCNOMGZILQIK-KMOMXXRPNA-N
InChICode InChI=1S/C22H26O8/c1-11(6-9-28-14(4)23)19(24)29-15-10-12(2)22(27)8-7-21(5,26)18(22)17-16(15)13(3)20(25)30-17/h6-8,15-18,26-27H,2-3,9-10H2,1,4-5H3/b11-6-/t15-,16-,17+,18+,21-,22+/m1/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@H](OC(=O)/C(C)=CCOC(C)=O)CC(=C)[C@]1(O)C=C[C@](C)(O)[C@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCalea jamaicensis Ref.
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