input word = C00022517

Metabolite InformationStructural formula
Name 8(17),13E-Labdadien-7alpha,15-diol diacetate
Formula C24H38O4
Mw 390.2770097
CAS RN 130395-29-8
C_ID C00022517 ,
InChIKey KNTOFVMVMOOLLQ-XISYFVQCNA-N
InChICode InChI=1S/C24H38O4/c1-16(11-14-27-18(3)25)9-10-20-17(2)21(28-19(4)26)15-22-23(5,6)12-8-13-24(20,22)7/h11,20-22H,2,8-10,12-15H2,1,3-7H3/b16-11+/t20-,21+,22-,24-/m0/s1
SMILES C=C1[C@H](OC(C)=O)C[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC/C(C)=C/COC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOrobanchaceaeParentucellia latifolia Ref.
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