input word = C00010791

Metabolite InformationStructural formula
Name Secogaliosdie
Formula C17H24O12
Mw 420.12677623
CAS RN 61774-57-0
C_ID C00010791 ,
InChIKey PSTHWEAXBIXPRZ-XWKVPKGVNA-N
InChICode InChI=1S/C17H24O12/c1-24-14(22)6-4-25-16(9-5(6)2-8-27-13(9)15(23)28-8)29-17-12(21)11(20)10(19)7(3-18)26-17/h4-5,7-13,15-21,23H,2-3H2,1H3/t5-,7-,8+,9+,10-,11-,12+,13+,15-,16+,17+/m1/s1
SMILES [C@H]12[C@H]([C@@H](OC=C1C(=O)OC)O[C@@H]1O[C@@H]([C@H]([C@H]([C@@H]1O)O)O)CO)[C@@H]1O[C@H](C2)O[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeGalium album Ref.
PlantaeRubiaceaeGalium mollugo Ref.
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