Compound Identification
SMILES
C\C(\C=C\[C@]1(O)[C@@]2(C)CO[C@]1(C)C[C@H](C2)O[C@@H]1O[C@H](CO)[C@@H](O)C(O)[C@H]1O)=C/C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIKey
InChIKey=ZWXQYKJGKBOZFX-RESFHQGASA-N
Formula
C27H42O15
Mass
606.618
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Sesquiterpenoids
- Level 5 Abscisic acids and derivatives
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Subclass
Sesquiterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Sesquiterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Abscisic acids and derivatives
Alternative Parents
Terpene glycosides Fatty acyl glycosides of mono- and disaccharides O-glycosyl compounds Fatty acid esters Oxepanes Oxanes Monosaccharides Tertiary alcohols Tetrahydrofurans Enoate esters Cyclic alcohols and derivatives Secondary alcohols Polyols Oxacyclic compounds Monocarboxylic acids and derivatives Acetals Dialkyl ethers Carbonyl compounds Organic oxides Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Abscisic acid - Terpene glycoside - Fatty acyl glycoside - Fatty acyl glycoside of mono- or disaccharide - O-glycosyl compound - Glycosyl compound - Oxepane - Fatty acid ester - Monosaccharide - Oxane - Fatty acyl - Alpha,beta-unsaturated carboxylic ester - Cyclic alcohol - Enoate ester - Tertiary alcohol - Tetrahydrofuran - Secondary alcohol - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Polyol - Monocarboxylic acid or derivatives - Alcohol - Carbonyl group - Organic oxygen compound - Primary alcohol - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as abscisic acids and derivatives. These are terpene compounds containing the abscisic acid moiety, which is characterized by a 3-methylpenta-2,4-dienoic acid attached to the C1 carbon of a 4-oxocyclohex-2-ene moiety.
External Descriptors
Not available