Compound Identification
SMILES
COC1=CC2=C(O[C@H]([C@H](O)[C@H]2O)C2=CC(OC)=CC=C2)C=C1
InChIKey
InChIKey=DDCXNFVHFBINJH-BBWFWOEESA-N
Formula
C17H18O5
Mass
302.326
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Flavonoids
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Subclass
Flavans
- Level 5 Leucoanthocyanidins
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Subclass
Flavans
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Class
Flavonoids
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Flavonoids
Subclass
Flavans
Intermediate Tree Nodes
Not available
Direct Parent
Leucoanthocyanidins
Alternative Parents
6-O-methylated flavonoids 3'-O-methylated flavonoids 4-hydroxyflavonoids 3-hydroxyflavonoids 1-benzopyrans Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Secondary alcohols 1,2-diols Oxacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3p-methoxyflavonoid-skeleton - 6-methoxyflavonoid-skeleton - Leucoanthocyanidin-skeleton - 3-hydroxyflavonoid - 4-hydroxyflavonoid - Hydroxyflavonoid - 1-benzopyran - Chromane - Benzopyran - Phenoxy compound - Methoxybenzene - Anisole - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Secondary alcohol - 1,2-diol - Organoheterocyclic compound - Oxacycle - Ether - Organooxygen compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as leucoanthocyanidins. These are flavonoids consisting of a flavan (3,4-dihydro-2-phenyl-2H-1-benzopyran) moiety that carries two hydroxy groups at the C3- and C4-positions.
External Descriptors
Not available