Compound Identification
SMILES
CC(C[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)COC(=O)C1=C2C=CC=CC2=CC2=CC=CC=C12)[C@H]1CC[C@@]2(C)C1CC[C@]1(C)C2CCC2[C@@]3(C)C[C@H](C)CC(C)(C)C3CC[C@@]12C
InChIKey
InChIKey=JXKDDIQAVMDTGE-AQTAFCIWSA-N
Formula
C51H72O6
Mass
781.131
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Hopanoids
- Level 5 Bacteriohopanoids
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Subclass
Hopanoids
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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
Hopanoids
Intermediate Tree Nodes
Not available
Direct Parent
Bacteriohopanoids
Alternative Parents
Sesquaterpenoids Hydroxysteroids Anthracenecarboxylic acids Naphthalenecarboxylic acids and derivatives Fatty alcohols Monosaccharides Secondary alcohols Carboxylic acid esters 1,2-diols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Bacteriohopane skeleton - Sesquaterpenoid - 27-hydroxysteroid - 25-hydroxysteroid - 24-hydroxysteroid - 23-hydroxysteroid - Hydroxysteroid - Anthracene carboxylic acid - Steroid - Anthracene carboxylic acid or derivatives - Anthracene - 1-naphthalenecarboxylic acid or derivatives - Fatty alcohol - Fatty acyl - Benzenoid - Monosaccharide - 1,2-diol - Carboxylic acid ester - Secondary alcohol - Polyol - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as bacteriohopanoids. These are bacterial terpenoids structurally characterized by a C30 skeleton, which is usually conjugated to a C5 (usually hydroxylated) unit linked by a carbon-carbon bond.
External Descriptors
Not available