Compound Identification
SMILES
COC(=O)[C@H]1C2C(=CC[C@@H](OS(=O)(=O)C3=CC=C(C)C=C3)[C@@]2(C)C(=O)OC)C2CC[C@@]3(C[C@]12CC3=C)OC(C)=O
InChIKey
InChIKey=DEWOBMHIBSVMIO-NKCFNEPKSA-N
Formula
C30H36O9S
Mass
572.67
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Diterpenoids
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Level 5
Gibberellins
- Level 6 C19-gibberellins
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Level 5
Gibberellins
-
Subclass
Diterpenoids
-
Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Diterpenoids
Intermediate Tree Nodes
Gibberellins
Direct Parent
C19-gibberellins
Alternative Parents
p-Methylbenzenesulfonates Benzenesulfonate esters Tosyl compounds Tricarboxylic acids and derivatives Benzenesulfonyl compounds Arylsulfonic acids and derivatives Organosulfonic acid esters Sulfonyls Methyl esters Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
20-norgibberellane diterpenoid - Benzenesulfonate ester - P-methylbenzenesulfonate - Tosyl compound - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Tricarboxylic acid or derivatives - Toluene - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid ester - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Methyl ester - Sulfonyl - Carboxylic acid ester - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as c19-gibberellins. These are gibberellins containing 19 carbon atoms, with the COOH group in position 7. In nearly all C19-gibberellins, the carboxyl group at C-4 forms a lactone ring at C-10, a configuration which arises in connection with the loss of the extra C-20 atom.
External Descriptors
Not available