input word = C00010770

Metabolite InformationStructural formula
Name Jasmolactone D
Formula C26H28O11
Mw 516.16316174
CAS RN 125339-18-6
C_ID C00010770 ,
InChIKey GJLGUDQPCIWEPW-CAIKQOTANA-N
InChICode InChI=1S/C26H28O11/c27-18-3-1-14(9-20(18)29)5-7-34-22-13-36-23(31)11-16-17(12-37-26(33)24(16)22)25(32)35-8-6-15-2-4-19(28)21(30)10-15/h1-4,9-10,12,16,22,24,26-30,33H,5-8,11,13H2/t16-,22-,24+,26-/m1/s1
SMILES C1(=CO[C@H]([C@H]2[C@@H]1CC(=O)OC[C@H]2OCCc1cc(c(cc1)O)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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