Compound Identification
SMILES
[H][C@@]12OC(=O)[C@]3(C)CCC[C@@](C)(C13[H])C1(O)C(=C2)[C@@]2([H])OC(=O)CC[C@@]2(C)C1([H])O
InChIKey
InChIKey=JMAPMWNXFJANPJ-LCAGKBDWSA-N
Formula
C20H26O6
Mass
362.422
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactones
- Subclass Delta valerolactones
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Class
Lactones
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactones
Subclass
Delta valerolactones
Intermediate Tree Nodes
Not available
Direct Parent
Delta valerolactones
Alternative Parents
Oxanes Gamma butyrolactones Dicarboxylic acids and derivatives Tetrahydrofurans Tertiary alcohols Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters 1,2-diols Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Delta valerolactone - Delta_valerolactone - Dicarboxylic acid or derivatives - Gamma butyrolactone - Oxane - Cyclic alcohol - Tetrahydrofuran - Tertiary alcohol - 1,2-diol - Carboxylic acid ester - Secondary alcohol - Oxacycle - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as delta valerolactones. These are cyclic organic compounds containing an oxan-2- one moiety.
External Descriptors
Not available