Summary

IMPPAT Phytochemical identifier: IMPHY016681

Phytochemical name: Hexaethylene glycol monododecyl ether

Synonymous chemical names:
hexaethylene glycol monododecyl ether

External chemical identifiers:
CID:18282, ZINC:ZINC000095784968, SureChEMBL:SCHEMBL61970

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Chemical structure information

SMILES:
CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCO

InChI:
InChI=1S/C24H50O7/c1-2-3-4-5-6-7-8-9-10-11-13-26-15-17-28-19-21-30-23-24-31-22-20-29-18-16-27-14-12-25/h25H,2-24H2,1H3

InChIKey:
OJCFEGKCRWEVSN-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCOCCOCCOCCOCCOCCOCCO

Functional groups:
CO, COC

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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: Glycerolipids

NP Classifier Class: Monoacylglycerols

NP-Likeness score: 0.068

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Chemical structure download