Compound Identification
SMILES
COC1=CC(=CC(OC)=C1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](OC2C[C@H](C(O)C(CO)O2)N(C)C)C2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=JROSOBPGIUYUEU-JTRVZODNSA-N
Formula
C30H37NO11
Mass
587.622
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lignans, neolignans and related compounds
-
Class
Lignan lactones
- Subclass Podophyllotoxins
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Class
Lignan lactones
-
Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Lignan lactones
Subclass
Podophyllotoxins
Intermediate Tree Nodes
Not available
Direct Parent
Podophyllotoxins
Alternative Parents
Lignan glycosides Aryltetralin lignans Aminoglycosides Furanonaphthodioxoles Hexoses O-glycosyl compounds Tetralins Benzodioxoles Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Oxanes Gamma butyrolactones Oxolanes Amino acids and derivatives Trialkylamines Secondary alcohols Carboxylic acid esters 1,2-aminoalcohols Monocarboxylic acids and derivatives Acetals Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds Primary alcohols Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Podophyllotoxin - Lignan glycoside - Aminoglycoside core - 1-aryltetralin lignan - Linear furanonaphthodioxole - Naphthofuran - Hexose monosaccharide - Glycosyl compound - O-glycosyl compound - Tetralin - Benzodioxole - Phenol ether - Phenoxy compound - Methoxybenzene - Anisole - Amino saccharide - Alkyl aryl ether - Monosaccharide - Monocyclic benzene moiety - Benzenoid - Gamma butyrolactone - Oxane - Oxolane - Lactone - Tertiary aliphatic amine - Amino acid or derivatives - 1,2-aminoalcohol - Tertiary amine - Secondary alcohol - Carboxylic acid ester - Acetal - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Carbonyl group - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Primary alcohol - Amine - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as podophyllotoxins. These are tetralin lignans in which the benzene moiety of the tetralin skeleton is fused to a 1,3-dioxolane and the cyclohexane is fused to a butyrolactone (pyrrolidin-2-one).
External Descriptors
Not available