Summary

IMPPAT Phytochemical identifier: IMPHY015952

Phytochemical name: Tetrahydroaplotaxene

Synonymous chemical names:
tetrahydroaplotaxene

External chemical identifiers:
CID:11413696, SureChEMBL:SCHEMBL1142776

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Chemical structure information

SMILES:
CCCCCCCC/C=CCCCCCC=C

InChI:
InChI=1S/C17H32/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3,15,17H,1,4-14,16H2,2H3/b17-15-

InChIKey:
ZCNSOBXQEHNQMJ-ICFOKQHNSA-N

DeepSMILES:
CCCCCCCC/C=CCCCCCC=C

Functional groups:
C/C=CC, C=CC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Unsaturated hydrocarbons

ClassyFire Subclass: Olefins

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 0.949

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Chemical structure download