Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)O[C@@H]1C2C[C@H](OC(=O)C3=CC=CO3)[C@]3(C)[C@@H](OC(C)=O)[C@H](C[C@](C)(O)C13OC2(C)C)OC(C)=O
InChIKey
InChIKey=FZJDVIPZKWHXEZ-LRHWELJUSA-N
Formula
C32H38O12
Mass
614.644
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
Tetracarboxylic acids and derivatives P-methoxybenzoic acids and derivatives Benzoic acid esters Furoic acid esters Phenoxy compounds Anisoles Methoxybenzenes Benzoyl derivatives Oxepanes Alkyl aryl ethers Cyclitols and derivatives Tetrahydrofurans Tertiary alcohols Heteroaromatic compounds Carboxylic acid esters Dialkyl ethers Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Agarofuran - Tetracarboxylic acid or derivatives - P-methoxybenzoic acid or derivatives - Benzoate ester - Furoic acid ester - Benzoic acid or derivatives - Furoic acid or derivatives - Phenol ether - Phenoxy compound - Methoxybenzene - Anisole - Benzoyl - Oxepane - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Cyclitol or derivatives - Cyclic alcohol - Tertiary alcohol - Furan - Tetrahydrofuran - Heteroaromatic compound - Carboxylic acid ester - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Carboxylic acid derivative - Alcohol - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - 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