input word = C00022533

Metabolite InformationStructural formula
Name 3alpha-Hydroxy-5,6-dehydrochiliolide
Formula C20H26O4
Mw 330.18310932
CAS RN 102904-49-4
C_ID C00022533 ,
InChIKey WVRDZXWBGHINPN-CFOKKLHRNA-N
InChICode InChI=1S/C20H26O4/c1-12-4-5-14-15(6-7-17(21)19(14,2)3)20(12)10-16(24-18(20)22)13-8-9-23-11-13/h5,8-9,11-12,15-17,21H,4,6-7,10H2,1-3H3/t12-,15+,16+,17-,20-/m1/s1
SMILES C[C@@H]1CC=C2[C@H](CC[C@@H](O)C2(C)C)[C@@]12C[C@@H](c1ccoc1)OC2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeNardophyllum lanatum Ref.
--Chiliotrichium rosmarinifolium Ref.
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OrganismNardophyllum lanatum
ReferenceJakupovic,Tetrahedron,42,(1986),1305