Compound Identification
SMILES
C[C@@H]1CC[C@H](OC\C=C\C2=CC=CC=C2)[C@@]2(C)[C@H](OC(=O)C3=CC=CC=C3)[C@H](O)[C@@H]3[C@@H](OC(C)=O)[C@]12OC3(C)C
InChIKey
InChIKey=IODSNYIAYCZZQE-NQHFIICKSA-N
Formula
C33H40O7
Mass
548.676
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Sesquiterpenoids
- Level 5 Agarofurans
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Subclass
Sesquiterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Sesquiterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Agarofurans
Alternative Parents
Benzoic acid esters Styrenes Benzoyl derivatives Oxepanes Dicarboxylic acids and derivatives Tetrahydrofurans Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Agarofuran - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Styrene - Oxepane - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Benzenoid - Cyclic alcohol - Tetrahydrofuran - Carboxylic acid ester - Secondary alcohol - Organoheterocyclic compound - Ether - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Organooxygen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as agarofurans. These are organic compounds containing an agarofuran moiety( a three-ring system, with core fragment oxatricyclo[7.2.1.0^{1,6}]dodec-2-ene).
External Descriptors
Not available