input word = C00049984

Metabolite InformationStructural formula
Name Angustanoic acid F
Formula C20H28O3
Mw 316.20384476
CAS RN 104998-60-9
C_ID C00049984 ,
InChIKey ILQLITDRYFHAGM-FHOCCHNENA-N
InChICode InChI=1S/C20H28O3/c1-18(2,23)14-7-8-15-13(12-14)6-9-16-19(15,3)10-5-11-20(16,4)17(21)22/h7-8,12,16,23H,5-6,9-11H2,1-4H3,(H,21,22)/t16-,19-,20+/m1/s1
SMILES c1c2c(cc(c1)C(C)(C)O)CC[C@@H]1[C@@]2(CCC[C@@]1(C(=O)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIlliciaceaeIllicium angustisepalum Ref.
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