input word = C00019861

Metabolite InformationStructural formula
Name 1',2',6',7',8'-Epicyclolycoserone
Formula C25H30O5
Mw 410.20932407
CAS RN 116498-57-8
C_ID C00019861 ,
InChIKey OIVSDRARUTXWJF-MIMNKUHANA-N
InChICode InChI=1S/C25H30O5/c1-12(2)11-18(26)25-15(5)16-10-9-14(4)19(16)22(29-25)21-23(30-25)20-13(3)7-6-8-17(20)28-24(21)27/h6-8,12,14-16,19,22H,9-11H2,1-5H3/t14-,15-,16-,19-,22-,25-/m0/s1
SMILES Cc1cccc2oc(=O)c3c(c12)O[C@@]1(C(=O)CC(C)C)O[C@H]3[C@@H]2[C@@H](CC[C@@H]2C)[C@@H]1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAphyllocladus denticulatus Ref.
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