Compound Identification
SMILES
CC1=CN=C(CO[C@@H]2[C@H](O)[C@@H](O)[C@@H](OCC3=NC=C(C)C=C3)[C@@H](CC3=CC=CC=C3)S(=O)(=O)[C@@H]2CC2=CC=CC=C2)C=C1
InChIKey
InChIKey=CTACQMPTZXDPDV-FCJVTMLMSA-N
Formula
C34H38N2O6S
Mass
602.75
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Thiepanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiepanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Thiepanes
Alternative Parents
Methylpyridines Benzene and substituted derivatives Sulfones Heteroaromatic compounds Secondary alcohols 1,2-diols Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Methylpyridine - Thiepane - Monocyclic benzene moiety - Pyridine - Benzenoid - Sulfone - Heteroaromatic compound - 1,2-diol - Secondary alcohol - Dialkyl ether - Ether - Azacycle - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Alcohol - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiepanes. These are organic compounds containing a heptane ring in which one carbon atom is replaced by a sulfur atom.
External Descriptors
Not available