input word = C00047639

Metabolite InformationStructural formula
Name 14,15beta-Dihydroxyklaineanone
Formula C20H28O8
Mw 396.17841787
CAS RN 137359-82-1
C_ID C00047639 ,
InChIKey NWNMAVFXIRDAPM-MMNOTISFNA-N
InChICode InChI=1S/C20H28O8/c1-7-5-10(21)15(24)18(3)9(7)6-11-19(4)14(18)13(23)12(22)8(2)20(19,27)16(25)17(26)28-11/h5,8-9,11-16,22-25,27H,6H2,1-4H3/t8-,9-,11+,12+,13-,14+,15+,16-,18-,19+,20-/m0/s1
SMILES CC1=CC(=O)[C@@H](O)[C@]2(C)[C@H]3[C@@H](O)[C@H](O)[C@H](C)[C@]4(O)[C@@H](O)C(=O)O[C@H](C[C@@H]12)[C@]34C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSimaroubaceaeEurycoma longifolia Ref.
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