Compound Identification
SMILES
[Pt+4].[O-]C(=O)C([O-])=O.[NH-][C@H]1CCCC[C@@H]1[NH-].FC1=CNC(=O)NC1=O.CC(=O)O[C@@]12CO[C@@H]1C[C@H](O)[C@]1(C)[C@@H]2[C@H](OC(=O)C2=CC=CC=C2)[C@]2(O)C[C@H](OC(=O)C(O)[C@@H](NC(=O)OC(C)(C)C)C3=CC=CC=C3)C(C)=C([C@@H](O)C1=O)C2(C)C
InChIKey
InChIKey=CNZOFNMWZBNPLL-OSKRVHINSA-L
Formula
C55H68FN5O20Pt
Mass
1333.246
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Diterpenoids
- Level 5 Taxanes and derivatives
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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
Taxanes and derivatives
Alternative Parents
Benzoic acid esters Tricarboxylic acids and derivatives Benzoyl derivatives Pyrimidones Halopyrimidines Fatty acid esters Monosaccharides Hydropyrimidines Beta-hydroxy ketones Acyloins Vinylogous amides Tertiary alcohols Heteroaromatic compounds Enoate esters Dicarboximides Carbamate esters Alpha-hydroxy ketones Secondary alcohols Oxetanes Organic carbonic acids and derivatives Lactams Cyclic alcohols and derivatives Vinyl fluorides Oxacyclic compounds Organic transition metal salts Organic metal halides Fluoroalkenes Dialkyl ethers Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organofluorides Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Taxane diterpenoid - Benzoate ester - Tricarboxylic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Pyrimidone - Halopyrimidine - Fatty acid ester - Fatty acyl - Benzenoid - Pyrimidine - Monosaccharide - 1,2,3,4-tetrahydropyrimidine - Hydropyrimidine - Beta-hydroxy ketone - Monocyclic benzene moiety - Acyloin - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carbamic acid ester - Tertiary alcohol - Dicarboximide - Cyclic alcohol - Alpha-hydroxy ketone - Secondary alcohol - Oxetane - Carbonic acid derivative - Lactam - Ketone - Carboxylic acid ester - Organic metal halide - Oxacycle - Azacycle - Organic transition metal salt - Fluoroalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl fluoride - Ether - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as taxanes and derivatives. These are diterpenoids with a structure based either on the taxane skeleton, or a derivative thereof. In term of phytochemistry, several derivatives of the taxane skeleton exist: 2(3->20)-abeotaxane, 3,11-cyclotaxane, 11(15->1),11(10->9)-abeotaxane, 3,8-seco-taxane, and 11(15->1)-abeotaxane, among others. More complex skeletons have been found recently, which include the taxane-derived [3.3.3] propellane ring system.
External Descriptors
Not available