input word = C00034906

Metabolite InformationStructural formula
Name Tokinolide B
Formula C24H28O4
Mw 380.19875938
CAS RN 112966-16-2
C_ID C00034906 ,
InChIKey BSZGLQXKLRCULB-QWOJVNJFNA-N
InChICode InChI=1S/C24H28O4/c1-4-5-10-19-23-12-11-15(13-18(23)22(26)27-19)20(14(2)3)24(23)17-9-7-6-8-16(17)21(25)28-24/h6,8,10,13-15,20H,4-5,7,9,11-12H2,1-3H3/b19-10-/t15-,20-,23+,24-/m1/s1
SMILES [C@H]1([C@H]2C=C3[C@]([C@]41C1=C(C(=O)O4)C=CCC1)(/C(=C/CCC)/OC3=O)CC2)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAngelica acutiloba Ref.
PlantaeApiaceaeLigusticum chuanxiong Ref.
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