input word = C00033533

Metabolite InformationStructural formula
Name 15-Hydroxyhypocretenolide beta-glucopyranoside
Formula C21H26O9
Mw 422.15768243
CAS RN 957796-47-3
C_ID C00033533 ,
InChIKey MUNHAFTZKSJCBN-ICGMSZTINA-N
InChICode InChI=1S/C21H26O9/c1-9-3-4-11-6-21(30-19(27)10(11)2)12(5-13(23)15(9)21)8-28-20-18(26)17(25)16(24)14(7-22)29-20/h5,11,14,16-18,20,22,24-26H,2-4,6-8H2,1H3/t11-,14-,16-,17+,18-,20-,21+/m1/s1
SMILES C=C1C(=O)O[C@]23C[C@H]1CCC(C)=C2C(=O)C=C3CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeLeontodon rosani Fiori Ref.
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OrganismLeontodon rosani Fiori
ReferenceZidorn,Phytochem.,69,(2008),2270