input word = C00023243

Metabolite InformationStructural formula
Name Hydratoperidinin
Formula C39H52O8
Mw 648.36621864
CAS RN 866025-63-0
C_ID C00023243 ,
InChIKey OUSTUFWOJHCUGD-JUJIKXSINA-N
InChICode InChI=1S/C39H52O8/c1-26(16-17-33-35(4,5)24-32(46-28(3)40)25-37(33,8)43)14-12-10-11-13-15-27(2)20-31-21-29(34(42)47-31)18-19-39(45)36(6,7)22-30(41)23-38(39,9)44/h10-16,18-21,30,32,41,43-45H,22-25H2,1-9H3/b12-10+,13-11+,19-18+,26-14+,27-15+,31-20-/t17-,30+,32+,37-,38-,39+/m1/s1
SMILES C(=C\[C@@]1(C(C[C@@H](C[C@@]1(C)O)O)(C)C)O)/C1=C/C(=C/C(=C/C=C/C=C/C=C(/C=C=C2C(C[C@@H](C[C@@]2(C)O)OC(=O)C)(C)C)\C)/C)/OC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCorbiculidaeCorbicula japonica Ref.
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OrganismCorbicula japonica
ReferenceMaoka,J. Agric. Food Chem.,53,(2005),8357