Summary

IMPPAT Phytochemical identifier: IMPHY003844

Phytochemical name: 2-Penten-1-OL

Synonymous chemical names:
(e)-2-pentenol, (e)-pent-2-en-1-ol, 2-penten-1-ol

External chemical identifiers:
CID:5364920, ChEBI:89943, ZINC:ZINC000006661425, FDASRS:5173J66S69, SureChEMBL:SCHEMBL96103

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Chemical structure information

SMILES:
CC/C=C/CO

InChI:
InChI=1S/C5H10O/c1-2-3-4-5-6/h3-4,6H,2,5H2,1H3/b4-3+

InChIKey:
BTSIZIIPFNVMHF-ONEGZZNKSA-N

DeepSMILES:
CC/C=C/CO

Functional groups:
C/C=C/C, CO

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Alcohols and polyols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 2.605

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Chemical structure download