input word = C00021895

Metabolite InformationStructural formula
Name 4alpha-Hydroxygymnomitryl cinnamate
Formula C24H30O3
Mw 366.21949482
CAS RN
C_ID C00021895 ,
InChIKey WABBYVLOAKZXSA-VHQXHZMVNA-N
InChICode InChI=1S/C24H30O3/c1-16-18(25)15-23(3)21(20(16)22(2)13-8-14-24(22,23)4)27-19(26)12-11-17-9-6-5-7-10-17/h5-7,9-12,18,20-21,25H,1,8,13-15H2,2-4H3/b12-11+/t18-,20-,21-,22-,23+,24-/m0/s1
SMILES [C@@H]1(C[C@]2([C@@]3([C@]([C@@H](C1=C)[C@@H]2OC(=O)/C=C/c1ccccc1)(CCC3)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlagiochilaceaePlagiochila trabeculata Ref.
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OrganismPlagiochila trabeculata
ReferenceToyota,Phytochem.,27,(1988),2161