input word = C00023421

Metabolite InformationStructural formula
Name Methyl 15-isobutyloxy-7-labden-17-oate
Formula C25H42O4
Mw 406.30830983
CAS RN
C_ID C00023421 ,
InChIKey LKEDBIJRCHKPBF-ZWZUUQAANA-N
InChICode InChI=1S/C25H42O4/c1-17(2)22(26)29-16-13-18(3)9-11-20-19(23(27)28-7)10-12-21-24(4,5)14-8-15-25(20,21)6/h10,17-18,20-21H,8-9,11-16H2,1-7H3/t18-,20-,21-,25-/m1/s1
SMILES C1CC(C)([C@@H]2[C@](C1)([C@@H](C(=CC2)C(=O)OC)CC[C@H](CCOC(=O)C(C)C)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCistaceaeHalimium viscosum Ref.
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