Compound Identification
SMILES
COC1=C(C=C(CC(=O)OCC2=C[C@H]3[C@H]4OC5(CC6=CC=CC=C6)O[C@]4(C[C@@H](C)[C@]3(O5)[C@@H]3C=C(C)C(=O)[C@@]3(O)C2)C(C)=C)C=C1)N=[N+]=[N-]
InChIKey
InChIKey=UUGAJBSMRUPSPP-IHCAYWNCSA-N
Formula
C37H39N3O8
Mass
653.732
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
- Subclass Diterpenoids
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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
Diterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Rhamnofolane and daphnane diterpenoids
Alternative Parents
Methoxyanilines Phenylazides Phenoxy compounds Anisoles Methoxybenzenes Ortho esters 1,3-dioxepanes Alkyl aryl ethers Carboxylic acid orthoesters 1,3-dioxanes Tertiary alcohols 1,3-dioxolanes Azo compounds Azo imides Carboxylic acid esters Ketones Oxacyclic compounds Monocarboxylic acids and derivatives Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Daphnane diterpenoid - Methoxyaniline - Phenol ether - Phenylazide - Anisole - Phenoxy compound - Methoxybenzene - Dioxepane - 1,3-dioxepane - Carboxylic acid orthoester - Alkyl aryl ether - Ortho ester - Benzenoid - Meta-dioxane - Monocyclic benzene moiety - Meta-dioxolane - Tertiary alcohol - Azo compound - Carboxylic acid ester - Ketone - Orthocarboxylic acid derivative - Azo imide - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Oxacycle - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Alcohol - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as rhamnofolane and daphnane diterpenoids. These are diterpenoids with a structure based on one the rhamnofolane or daphnane skeleton. The rhamnofolane and daphnane skeletons are closely related, being formally derived from casbane by two cyclizations (6,10 and 5,14) followed by cleavage of the 1,15 (daphnane) or 2,15 (rhamnofolane) cyclopropane bonds.
External Descriptors
Not available