Compound Identification
SMILES
COC(=O)[C@@]1(C[C@H](OCC(=O)OC(C)(C)C)[C@@H](NC(C)=O)[C@@H](O1)[C@H](OC(C)=O)[C@@H](CNC(C)=O)OC(C)=O)SC1=CC=CC=C1
InChIKey
InChIKey=VFPVJEPSKNYVML-BMDBIABOSA-N
Formula
C30H42N2O12S
Mass
654.73
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Level 5
Sugar acids and derivatives
-
Level 6
Glucuronic acid derivatives
-
Level 7
Glucuronides
- Level 8 C-glucuronides
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Level 7
Glucuronides
-
Level 6
Glucuronic acid derivatives
-
Level 5
Sugar acids and derivatives
-
Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Sugar acids and derivatives - Glucuronic acid derivatives - Glucuronides
Direct Parent
C-glucuronides
Alternative Parents
Tetracarboxylic acids and derivatives C-glycosyl compounds Aryl thioethers Monothioketals Pyrans Oxanes Benzene and substituted derivatives Acetamides Methyl esters Secondary carboxylic acid amides Sulfenyl compounds Oxacyclic compounds Dialkyl ethers Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
C-glucuronide - Tetracarboxylic acid or derivatives - C-glycosyl compound - Glycosyl compound - Aryl thioether - Monothioketal - Monocyclic benzene moiety - Benzenoid - Oxane - Pyran - Monothioacetal - Acetamide - Methyl ester - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Organoheterocyclic compound - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Sulfenyl compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organosulfur compound - Organopnictogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as c-glucuronides. These are glucuronides in which the aglycone is linked to the carbohydrate unit through a C-glycosidic bond.
External Descriptors
Not available