Summary

IMPPAT Phytochemical identifier: IMPHY013796

Phytochemical name: Tetratetracontane

Synonymous chemical names:
n-tetratetracontane, tetratetracontane

External chemical identifiers:
CID:23494, ChEBI:84289, ZINC:ZINC000006921186, FDASRS:FPX2NM4VIT, SureChEMBL:SCHEMBL198371, MolPort-003-930-808

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Chemical structure information

SMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

InChI:
InChI=1S/C44H90/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-44H2,1-2H3

InChIKey:
KMXFZRSJMDYPPG-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Saturated hydrocarbons

ClassyFire Subclass: Alkanes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 0.056

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Chemical structure download