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 C(=O)(/C(=C/C=C/[C@@]1(OC(=O)[C@@]23[C@@]([C@H]1CC3)(CC=C(C=C2)C)OC(=O)C)C)/C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePseudolarix amabilis Ref.
PlantaePinaceaePseudolarix kaempferi Ref.
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