Compound Identification
SMILES
COc1cc(\C=C\C(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H](O)[C@@H]2O)c2c(O)cc(O)c3cc(O)c([o+]c23)-c2ccc(O)c(O)c2)cc(OC)c1O
InChIKey
InChIKey=AIPFLPUUSLFLJC-YUTSNVJASA-O
Formula
C32H31O15
Mass
655.584
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Flavonoids
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Subclass
Flavonoid glycosides
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Level 5
Flavonoid O-glycosides
- Level 6 Anthocyanins
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Level 5
Flavonoid O-glycosides
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Subclass
Flavonoid glycosides
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Class
Flavonoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavonoid glycosides
Intermediate Tree Nodes
Flavonoid O-glycosides
Direct Parent
Anthocyanins
Alternative Parents
Flavonoid 8-C-glycosides 3'-hydroxyflavonoids 7-hydroxyflavonoids 5-hydroxyflavonoids 3-hydroxyflavonoids 4'-hydroxyflavonoids Anthocyanidins Phenolic glycosides Cinnamic acid esters Coumaric acids and derivatives C-glycosyl compounds 1-benzopyrans Methoxyphenols Dimethoxybenzenes Phenoxy compounds Anisoles Catechols Styrenes 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Fatty acid esters Monosaccharides Oxanes Heteroaromatic compounds Enoate esters Secondary alcohols Monocarboxylic acids and derivatives Oxacyclic compounds Polyols Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Anthocyanin - Anthocyanidin-8-c-glycoside - Flavonoid c-glycoside - Flavonoid-8-c-glycoside - 3'-hydroxyflavonoid - 3-hydroxyflavonoid - 4'-hydroxyflavonoid - 5-hydroxyflavonoid - 7-hydroxyflavonoid - Hydroxyflavonoid - Anthocyanidin - Phenolic glycoside - Coumaric acid or derivatives - Cinnamic acid or derivatives - Hydroxycinnamic acid or derivatives - Cinnamic acid ester - Glycosyl compound - C-glycosyl compound - 1-benzopyran - Dimethoxybenzene - Benzopyran - Methoxyphenol - M-dimethoxybenzene - Anisole - Styrene - Catechol - Phenol ether - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Phenol - Fatty acid ester - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Monosaccharide - Oxane - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Secondary alcohol - Dialkyl ether - Ether - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Polyol - Monocarboxylic acid or derivatives - Organic oxide - Hydrocarbon derivative - Carbonyl group - Alcohol - Organooxygen compound - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as anthocyanins. These are organic compounds containing a flavylium ion or 2-phenylchromenylium based skeleton bound to a sugar.
External Descriptors
Not available