Compound Identification
SMILES
CC[C@@]12CCC[C@@H](CC1)[C@H](O)[C@H](CC#C2)[C@H](O)CCc1ccc(O)c(OCCCc2ccnc(N)c2)c1
InChIKey
InChIKey=VZCDYFRTNLCASH-YVPJPYGASA-N
Formula
C31H42N2O4
Mass
506.687
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenols
-
Subclass
Methoxyphenols
- Level 5 Gingerdiols
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Subclass
Methoxyphenols
-
Class
Phenols
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenols
Subclass
Methoxyphenols
Intermediate Tree Nodes
Not available
Direct Parent
Gingerdiols
Alternative Parents
Sesquiterpenoids Polyhalopyridines Phenoxy compounds Phenol ethers Methylpyridines Hydroxypyridines Alkyl aryl ethers 2-halopyridines 1-hydroxy-2-unsubstituted benzenoids Imidolactams Heteroaromatic compounds Secondary alcohols Haloacetylenes and derivatives Azacyclic compounds Primary amines Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Gingerdiol - Sesquiterpenoid - Phenoxy compound - Polyhalopyridine - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - 2-halopyridine - Methylpyridine - Hydroxypyridine - Alkyl aryl ether - Imidolactam - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Secondary alcohol - Haloacetylene or derivatives - Azacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as gingerdiols. These are compounds containing a gingerdiol moiety, which is structurally characterized by a 4-hydroxy-3-methoxyphenyl group substituted at the C6 carbon atom by an alkane-2,4-diol.
External Descriptors
Not available