input word = C00056312

Metabolite InformationStructural formula
Name Gentiolutelin
Formula C10H16O4
Mw 200.104859
CAS RN 1002101-83-8
C_ID C00056312
InChIKey LXSAYHHNNBSFRW-XSPKLOCKSA-N
InChICode InChI=1S/C10H16O4/c1-6-8(12)5-7(3-4-11)9(6)10(13)14-2/h4,6-9,12H,3,5H2,1-2H3/t6-,7-,8-,9+/m0/s1
SMILES O[C@H]1C[C@H](CC=O)[C@H](C(OC)=O)[C@H]1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGentianaceaeGentiana lutea Ref.
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