input word = C00034069

Metabolite InformationStructural formula
Name Naucleidinal
Formula C21H30O9
Mw 426.18898256
CAS RN 281655-93-4
C_ID C00034069 ,
InChIKey KRIIHCDVUZEPQL-CVUOXGIQNA-N
InChICode InChI=1S/C21H30O9/c1-9-4-3-5-11-6-14(13(7-12(9)11)10(2)19(26)27)20(28)30-21-18(25)17(24)16(23)15(8-22)29-21/h6,10,13-18,21-25H,3-5,7-8H2,1-2H3,(H,26,27)/t10-,13+,14-,15-,16-,17+,18-,21+/m1/s1
SMILES CC1=C2CC(C(C)C(=O)O)C(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C2CCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeNauclea officinalis Ref.
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