input word = C00022409

Metabolite InformationStructural formula
Name 15-Acetoxy-7,13E-labdadien-17-oic acid
Formula C22H34O4
Mw 362.24570957
CAS RN 102867-66-3
C_ID C00022409 ,
InChIKey QCCOWTLREYYOFG-BSMYRDNENA-N
InChICode InChI=1S/C22H34O4/c1-15(11-14-26-16(2)23)7-9-18-17(20(24)25)8-10-19-21(3,4)12-6-13-22(18,19)5/h8,11,18-19H,6-7,9-10,12-14H2,1-5H3,(H,24,25)/b15-11+/t18-,19+,22+/m0/s1
SMILES CC(=O)OC/C=C(C)CC[C@H]1C(C(=O)O)=CCC2C(C)(C)CCC[C@@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCistaceaeHalimium viscosum Ref.
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