input word = C00045387

Metabolite InformationStructural formula
Name Pseudolaric acid B
(-)-Pseudolaric acid B
Formula C23H28O8
Mw 432.17841787
CAS RN 82508-31-4
C_ID C00045387 ,
InChIKey VDGOFNMYZYBUDT-LUNBBKGNNA-N
InChICode InChI=1S/C23H28O8/c1-14(18(25)26)6-5-10-21(3)17-9-12-22(20(28)31-21)11-7-16(19(27)29-4)8-13-23(17,22)30-15(2)24/h5-7,10,17H,8-9,11-13H2,1-4H3,(H,25,26)/b10-5+,14-6+/t17-,21-,22+,23-/m0/s1
SMILES C(=O)(/C(=C/C=C/[C@@]1(OC(=O)[C@@]23[C@@]([C@H]1CC3)(CCC(=CC2)C(=O)OC)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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