Compound Identification
SMILES
CO[C@H]1C[C@H](C)[C@@H](OC)C2=C[C@@H](O)C[C@@H](NC(=O)C(C)=CC=C[C@H](OC)[C@@H](OC(N)=O)\C(C)=C/[C@H](C)[C@H]1OC)C2=O
InChIKey
InChIKey=QXJLBJGWHDFICK-HXZAMKDNSA-N
Formula
C30H46N2O9
Mass
578.703
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
- Level 7 Cyclohexenones
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Cyclic ketones
Direct Parent
Cyclohexenones
Alternative Parents
N-acyl amines Alpha-branched alpha,beta-unsaturated ketones Enones Carbamate esters Acryloyl compounds Secondary alcohols Organic carbonic acids and derivatives Lactams Dialkyl ethers Carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Cyclohexenone - Alpha-branched alpha,beta-unsaturated-ketone - N-acyl-amine - Alpha,beta-unsaturated ketone - Carbamic acid ester - Enone - Acryloyl-group - Secondary alcohol - Carbonic acid derivative - Lactam - Carboxamide group - Azacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Carboxylic acid derivative - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclohexenones. These are compounds containing a cylohexenone moiety, which is a six-membered aliphatic ring that carries a ketone and has one endocyclic double bond.
External Descriptors
Not available