input word = C00010769

Metabolite InformationStructural formula
Name Jasmolactone C
Formula C26H28O10
Mw 500.16824712
CAS RN 125339-17-5
C_ID C00010769 ,
InChIKey PMJDDRRWBZBABZ-SCAWCDASNA-N
InChICode InChI=1S/C26H28O10/c27-17-4-1-15(2-5-17)7-9-33-22-14-35-23(30)12-18-19(13-36-26(32)24(18)22)25(31)34-10-8-16-3-6-20(28)21(29)11-16/h1-6,11,13,18,22,24,26-29,32H,7-10,12,14H2/t18-,22-,24+,26-/m1/s1
SMILES C1(=CO[C@H]([C@H]2[C@@H]1CC(=O)OC[C@H]2OCCc1ccc(cc1)O)O)C(=O)OCCc1ccc(c(c1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeJasminum multiflorum Ref.
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