input word = C00032370

Metabolite InformationStructural formula
Name Tracheloside
(-)-Tracheloside
Formula C27H34O12
Mw 550.20502655
CAS RN 33464-71-0
C_ID C00032370 ,
InChIKey LWYAMIUSVGPFKS-PPDODQRPNA-N
InChICode InChI=1S/C27H34O12/c1-34-17-6-4-14(9-19(17)35-2)8-16-13-37-26(32)27(16,33)11-15-5-7-18(20(10-15)36-3)38-25-24(31)23(30)22(29)21(12-28)39-25/h4-7,9-10,16,21-25,28-31,33H,8,11-13H2,1-3H3/t16-,21+,22+,23-,24+,25+,27-/m0/s1
SMILES COc1ccc(C[C@H]2COC(=O)[C@]2(O)Cc2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)cc1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeTrachelospermum asiaticum var.intermedium Ref.
PlantaeApocynaceaeTrachelospermum jasminoides Ref.
PlantaeAsteraceaeCarthamus tinctorius Ref.
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