Compound Identification
SMILES
[H][C@@]1(OC(=O)C2=COC=C2)[C@@]2([H])[C@@]([H])(OC(C)=O)[C@]([H])(OC(=O)C3=COC=C3)[C@]3(C)[C@]([H])(CC[C@](C)(O)[C@@]13OC2(C)C)OC(C)=O
InChIKey
InChIKey=DYAWIECXRLDDTM-JEYCTDGESA-N
Formula
C29H34O12
Mass
574.579
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
-
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 Furoic acid esters Furan-3-carboxylic acid esters Oxepanes Tetrahydrofurans Tertiary alcohols Heteroaromatic compounds Cyclic alcohols and derivatives Carboxylic acid esters Oxacyclic compounds Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Agarofuran - Tetracarboxylic acid or derivatives - Furoic acid ester - Furoic acid or derivatives - Furan-3-carboxylic acid ester - Furan-3-carboxylic acid or derivatives - Oxepane - Cyclic alcohol - Furan - Tertiary alcohol - Tetrahydrofuran - Heteroaromatic compound - Carboxylic acid ester - Ether - Dialkyl ether - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Alcohol - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - 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