Compound Identification
SMILES
CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)CN(CCCNC(=O)[C@@]2(O)CC[C@H]3[C@@H]4CCC5=CC(=O)CC[C@]5(C)[C@H]4[C@@H](O)C[C@]23C)[C@H](C)[C@@H](O)[C@]1(C)O
InChIKey
InChIKey=BNNASEDGPWHTHE-KROHSLPISA-N
Formula
C60H103N3O16
Mass
1122.489
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Steroids and steroid derivatives
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Subclass
Steroidal glycosides
- Level 5 Steroidal saponins
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Subclass
Steroidal glycosides
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Class
Steroids and steroid derivatives
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Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Steroids and steroid derivatives
Subclass
Steroidal glycosides
Intermediate Tree Nodes
Not available
Direct Parent
Steroidal saponins
Alternative Parents
Steroid lactones Androgens and derivatives Pregnane-type alkaloids 11-beta-hydroxysteroids 17-hydroxysteroids 3-oxo delta-4-steroids Aminoglycosides Azasteroids and derivatives Delta-4-steroids O-glycosyl compounds Alkaloids and derivatives Cyclohexenones Oxanes Monosaccharides Tertiary alcohols Lactones Trialkylamines Secondary carboxylic acid amides Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid esters Amino acids and derivatives 1,2-aminoalcohols Monocarboxylic acids and derivatives Dialkyl ethers Acetals Azacyclic compounds Polyols Oxacyclic compounds Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Steroidal saponin - Steroid lactone - Aminoglycoside core - Androgen-skeleton - Steroidal alkaloid - Androstane-skeleton - Pregnane-type alkaloid - 3-oxo-delta-4-steroid - 3-oxosteroid - Hydroxysteroid - Oxosteroid - 11-beta-hydroxysteroid - 17-hydroxysteroid - 11-hydroxysteroid - Azasteroid - Delta-4-steroid - Glycosyl compound - O-glycosyl compound - Alkaloid or derivatives - Cyclohexenone - Amino saccharide - Monosaccharide - Oxane - Tertiary alcohol - Cyclic alcohol - Carboxamide group - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Tertiary aliphatic amine - 1,2-aminoalcohol - Cyclic ketone - Lactone - Ketone - Secondary alcohol - Secondary carboxylic acid amide - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Polyol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Dialkyl ether - Ether - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alcohol - Organooxygen compound - Organonitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as steroidal saponins. These are saponins in which the aglycone moiety is a steroid. The steroidal aglycone is usually a spirostane, furostane, spirosolane, solanidane, or curcubitacin derivative.
External Descriptors
Not available