Summary

IMPPAT Phytochemical identifier: IMPPAT3_PHYID018006

Phytochemical name: 1-Octene, 3-(methoxymethoxy)-

Synonymous chemical names:
1-Octene, 3-(methoxymethoxy)-

External chemical identifiers:
CID:CID_542474

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Chemical structure information

SMILES:
CCCCCC(OCOC)C=C

InChI:
InChI=1S/C10H20O2/c1-4-6-7-8-10(5-2)12-9-11-3/h5,10H,2,4,6-9H2,1,3H3

InChIKey:
ZFRRXWJUXYQZBD-UHFFFAOYSA-N

DeepSMILES:
CCCCCCOCOC))))C=C

Functional groups:
COCOC, C=CC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Ethers

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty Acids and Conjugates

NP Classifier Class: Methoxy fatty acids

NP-Likeness score: 1.433

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Chemical structure download