input word = C00053140

Metabolite InformationStructural formula
Name Dibutyl phthalate
Butylphthalate
Formula C16H22O4
Mw 278.15180919
CAS RN 84-74-2
C_ID C00053140
InChIKey DOIRQSBPFJWKBE-UHFFFAOYSA-N
InChICode InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3
SMILES O=C(OCCCC)C1=CC=CC=C1C(OCCCC)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlliaceaeAllium cepa Ref.
PlantaeAsteraceaePetasites hybridus Ref.
PlantaeCaricaceaeCarica papaya Ref.
PlantaeCelastraceaeTripterygium wilfordii Ref.
PlantaeCeratophyllaceaeCeratophyllum demersum Ref.
PlantaeEuphorbiaceaeEuphorbia helioscopia Ref.
PlantaeLabiataePerilla frutescens Ref.
PlantaeMyrtaceaeAcca sellowiana Ref.
PlantaeNymphaeaceaeNymphaea caerulea Ref.
PlantaeSolanaceaeCapsicum annuum Ref.
PlantaeSolanaceaeNicotiana tabacum Ref.
PlantaeZingiberaceaeZingiber officinale Ref.
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OrganismCapsicum annuum
Referencehttps://doi.org/10.3724/SP.J.1238.2012.00106