input word = C00035713

Metabolite InformationStructural formula
Name Osmanthuside I
Formula C28H34O13
Mw 578.19994117
CAS RN 149155-71-5
C_ID C00035713 ,
InChIKey IGGZLIGWWTVKMJ-BJMVGYQFNA-N
InChICode InChI=1S/C28H34O13/c29-18-6-1-16(2-7-18)5-10-21(31)39-14-28(36)15-40-27(25(28)35)38-13-20-22(32)23(33)24(34)26(41-20)37-12-11-17-3-8-19(30)9-4-17/h1-10,20,22-27,29-30,32-36H,11-15H2/b10-5+/t20-,22-,23+,24-,25-,26-,27+,28-/m0/s1
SMILES C1[C@@]([C@H]([C@@H](O1)OC[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)OCCc1ccc(cc1)O)O)O)O)O)(O)COC(=O)/C=C/c1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBignoniaceaeTabebuia impetiginosa Ref.
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