input word = C00003081

Metabolite InformationStructural formula
Name Gardenoside
Formula C17H24O11
Mw 404.13186161
CAS RN 24512-62-7
C_ID C00003081 ,
InChIKey XJMPAUZQVRGFRE-JMXPXBEPNA-N
InChICode InChI=1S/C17H24O11/c1-25-14(23)8-5-26-15(10-7(8)2-3-17(10,24)6-19)28-16-13(22)12(21)11(20)9(4-18)27-16/h2-3,5,7,9-13,15-16,18-22,24H,4,6H2,1H3/t7-,9+,10+,11+,12-,13+,15-,16-,17-/m0/s1
SMILES [C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO)O[C@@H]1OC=C([C@H]2[C@H]1[C@@](C=C2)(O)CO)C(=O)OC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGaillardia jasminoides Ref.
PlantaeRubiaceaeDioecrescis erythroclada Ref.
PlantaeRubiaceaeGardenia jasminoides cv. fortuneana HARA Ref.
PlantaeRubiaceaeGardenia jasminoides f. grandiflora Ref.
PlantaeRubiaceaeGardenia jasminoides var. radicans Ref.
PlantaeRubiaceaeGenipa americana L. Ref.
PlantaeRubiaceaeRandia spinosa Ref.
PlantaeRubiaceaeRothmannia globosa Ref.
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OrganismGardenia jasminoides f. grandiflora
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter49