input word = C00023361

Metabolite InformationStructural formula
Name 3-Angeloyloxy-2,18-dihydroxy-8(17),13-labdadien-15,16-olide
Formula C25H36O6
Mw 432.25118888
CAS RN 99624-45-0
C_ID C00023361 ,
InChIKey URUJNQASZVVYAZ-FPCTYCJANA-N
InChICode InChI=1S/C25H36O6/c1-6-15(2)23(29)31-22-19(27)12-24(4)18(9-8-17-11-21(28)30-13-17)16(3)7-10-20(24)25(22,5)14-26/h6,11,18-20,22,26-27H,3,7-10,12-14H2,1-2,4-5H3/b15-6-/t18-,19+,20+,22-,24-,25-/m1/s1
SMILES [C@H]1([C@H]([C@@]([C@@H]2[C@](C1)([C@@H](C(=C)CC2)CCC1=CC(=O)OC1)C)(CO)C)OC(=O)/C(=C\C)/C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGutierrezia solbrigii Ref.
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