Compound Identification
SMILES
CC1(C)OC23C(OC(=O)c4cccnc4)C1CC(OC(=O)C=Cc1ccccc1)C2(C)C(CCC3(C)O)OC(=O)c1cccnc1
InChIKey
InChIKey=HXHQWSIAAFTZPG-UHFFFAOYSA-N
Formula
C36H38N2O8
Mass
626.706
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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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
Cinnamic acid esters Tricarboxylic acids and derivatives Pyridinecarboxylic acids Styrenes Oxepanes Fatty acid esters Tetrahydrofurans Tertiary alcohols Enoate esters Heteroaromatic compounds Cyclic alcohols and derivatives Azacyclic compounds Oxacyclic compounds Dialkyl ethers Carbonyl compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Agarofuran - Cinnamic acid or derivatives - Cinnamic acid ester - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Tricarboxylic acid or derivatives - Styrene - Fatty acid ester - Oxepane - Monocyclic benzene moiety - Pyridine - Fatty acyl - Benzenoid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Tetrahydrofuran - Tertiary alcohol - Cyclic alcohol - Heteroaromatic compound - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Oxacycle - Dialkyl ether - Ether - Carbonyl group - Alcohol - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - 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