input word = C00034347

Metabolite InformationStructural formula
Name Youngiajaponicoside B
(-)-Youngiajaponicoside B
Formula C29H36O10
Mw 544.23084737
CAS RN 907999-36-4
C_ID C00034347 ,
InChIKey ZLFVIFKCPDYNII-AMDKGKCNNA-N
InChICode InChI=1S/C29H36O10/c1-13-4-9-18-14(2)28(35)39-26(18)23-15(3)20(11-19(13)23)36-29-25(34)27(24(33)21(12-30)37-29)38-22(32)10-16-5-7-17(31)8-6-16/h5-8,15,18-21,23-27,29-31,33-34H,1-2,4,9-12H2,3H3/t15-,18+,19+,20+,21-,23-,24-,25-,26+,27+,29-/m1/s1
SMILES [C@@H]12[C@H]3[C@H](C(=C)CC[C@H]1C(=C)C(=O)O2)C[C@@H]([C@H]3C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)OC(=O)Cc1ccc(cc1)O)O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeYoungia japonica (L.) DC. Ref.
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