input word = C00022370

Metabolite InformationStructural formula
Name 8alpha,13S-Epoxy-14-labden-6alpha-ol
Formula C20H34O2
Mw 306.25588033
CAS RN 65894-40-8
C_ID C00022370 ,
InChIKey UQDSVPUPHKZKFH-ROCWOXKTNA-N
InChICode InChI=1S/C20H34O2/c1-7-18(4)12-9-15-19(5)11-8-10-17(2,3)16(19)14(21)13-20(15,6)22-18/h7,14-16,21H,1,8-13H2,2-6H3/t14-,15+,16-,18+,19+,20+/m0/s1
SMILES C=C[C@]1(C)CC[C@@H]2[C@@]3(C)CCCC(C)(C)[C@@H]3[C@@H](O)C[C@@]2(C)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePinaceaePinus spp. Ref.
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