input word = C00023412

Metabolite InformationStructural formula
Name 3alpha-Angeloyloxy-18-hydroxy-ent-labd-8(17)-13dien-15,16-olide
Formula C25H36O5
Mw 416.25627426
CAS RN 99624-43-8
C_ID C00023412 ,
InChIKey YQEKVEAITURWAU-ZJAJHXJMNA-N
InChICode InChI=1S/C25H36O5/c1-6-16(2)23(28)30-21-11-12-24(4)19(9-8-18-13-22(27)29-14-18)17(3)7-10-20(24)25(21,5)15-26/h6,13,19-21,26H,3,7-12,14-15H2,1-2,4-5H3/b16-6+/t19-,20+,21-,24-,25-/m1/s1
SMILES C1[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
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGutierrezia solbrigii Ref.
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OrganismGutierrezia solbrigii
ReferenceJakupovic,Tetrahedron,41,(1985),4537