input word = C00053857

Metabolite InformationStructural formula
Name trans-Sesquisabinene hydrate
Formula C15H26O
Mw 222.19836545
CAS RN 145512-84-1
C_ID C00053857
InChIKey IRDFGGRWKUKANK-UHFFFAOYSA-N
InChICode InChI=1S/C15H26O/c1-11(2)6-5-7-12(3)15-9-8-14(4,16)13(15)10-15/h6,12-13,16H,5,7-10H2,1-4H3
SMILES CC(CC1)(O)C2C1(C(C)CC/C=C(C)/C)C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus reticulata Ref.
PlantaeRutaceaeMurraya paniculata Ref.
PlantaeRutaceaePoncirus trifoliate x Citrus sinensis Ref.
PlantaeZingiberaceaeZingiber officinale Ref.
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