input word = C00033063

Metabolite InformationStructural formula
Name Isolineolon
Isolineolone
Formula C21H32O5
Mw 364.22497413
CAS RN 7102-32-1
C_ID C00033063 ,
InChIKey YETBVMVJLDSXHU-ACHNRDCZNA-N
InChICode InChI=1S/C21H32O5/c1-12(22)15-6-9-21(26)19(15,3)17(24)11-16-18(2)7-5-14(23)10-13(18)4-8-20(16,21)25/h4,14-17,23-26H,5-11H2,1-3H3/t14-,15+,16+,17+,18-,19-,20-,21+/m0/s1
SMILES C1[C@@H](CC2=CC[C@@]3([C@@H]([C@]2(C1)C)C[C@H]([C@]1([C@@]3(CC[C@@H]1C(=O)C)O)C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAsclepias incarnata L. Ref.
PlantaeRanunculaceaeAdonis amurensis Ref.
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