input word = C00045388

Metabolite InformationStructural formula
Name Pseudolaric acid H
Formula C22H26O6
Mw 386.17293856
CAS RN 446030-29-1
C_ID C00045388 ,
InChIKey DMDYDVXEMCPQPC-TUGFKEIONA-N
InChICode InChI=1S/C22H26O6/c1-14-7-11-21-12-9-17(22(21,13-8-14)27-16(3)23)20(4,28-19(21)26)10-5-6-15(2)18(24)25/h5-8,10-11,17H,9,12-13H2,1-4H3,(H,24,25)/b10-5+,15-6+/t17-,20-,21+,22-/m0/s1
SMILES CC(=O)O[C@]12CC=C(C)C=C[C@]13CC[C@H]2[C@@](C)(/C=C/C=C(C)C(=O)O)OC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePseudolarix amabilis Ref.
PlantaePinaceaePseudolarix kaempferi Ref.
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OrganismPseudolarix amabilis
ReferenceYang, et al., JNP, 65, (2002), 1041