Summary

IMPPAT Phytochemical identifier: IMPHY010799

Phytochemical name: Tamarindienal

Synonymous chemical names:
tamarindienal

Chemical structure information

SMILES:
OC(=C)/C=C/C(=O)C=O.O=CC(=O)/C=C/C(=O)C

InChI:
InChI=1S/2C6H6O3/c2*1-5(8)2-3-6(9)4-7/h2-4H,1H3;2-4,8H,1H2/b2*3-2+

InChIKey:
CVAQUHGKMSSJIM-XQHVRGAUSA-N

DeepSMILES:
OC=C)/C=C/C=O)C=O.O=CC=O)/C=C/C=O)C

Functional groups:
C=C(O)/C=C/C(=O)C=O, CC(=O)/C=C/C(=O)C=O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Carbonyl compounds

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty Acids and Conjugates, Fatty acyls

NP Classifier Class: Fatty aldehydes, Oxo fatty acids

NP-Likeness score: 1.152

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Chemical structure download