input word = C00031317

Metabolite InformationStructural formula
Name Schizandronic acid
Formula C30H46O3
Mw 454.34469533
CAS RN 55511-14-3
C_ID C00031317 ,
InChIKey MZPNVEOVZSHYMZ-SOQQQTOQNA-N
InChICode InChI=1S/C30H46O3/c1-19(8-7-9-20(2)25(32)33)21-12-14-28(6)23-11-10-22-26(3,4)24(31)13-15-29(22)18-30(23,29)17-16-27(21,28)5/h9,19,21-23H,7-8,10-18H2,1-6H3,(H,32,33)/b20-9-/t19-,21-,22+,23+,27-,28+,29-,30+/m1/s1
SMILES C1C(=O)C([C@H]2[C@]3(C1)[C@]1([C@@H](CC2)[C@]2([C@](CC1)([C@H](CC2)[C@@H](CC/C=C(/C)\C(=O)O)C)C)C)C3)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIlliciaceaeIllicium verum Hook f. Ref.
PlantaeSchisandraceaeSchisandra micrantha Ref.
PlantaeSchisandraceaeSchisandra nigra Ref.
--kadsura peltigera Ref.
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