Compound Identification
SMILES
CC(C)[Si](O[C@]12O[C@H]1CN1\C(=N/C(=O)OC(C)(C)C)N([C@@H](COC(N)=O)[C@@H]3N=C(NC(=O)OC(C)(C)C)N(C(=O)OC(C)(C)C)[C@]213)C(=O)OC(C)(C)C)(C(C)C)C(C)C
InChIKey
InChIKey=OZKMQJLAIPNPCW-RTWDVKLHSA-N
Formula
C39H67N7O12Si
Mass
854.087
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Saxitoxins, gonyautoxins, and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Saxitoxins, gonyautoxins, and derivatives
Alternative Parents
Alkaloids and derivatives Imidazopyrimidines Diazinanes Morpholines Imidazolines Trialkylheterosilanes Carbamate esters Pyrrolidines Silyl ethers Guanidines Oxacyclic compounds Organic metalloid salts Azacyclic compounds Epoxides Carboximidamides Propargyl-type 1,3-dipolar organic compounds Organic oxides Imines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Saxitoxin-gonyautoxin skeleton - Imidazopyrimidine - Alkaloid or derivatives - 1,3-diazinane - Morpholine - Oxazinane - Trialkylheterosilane - 2-imidazoline - Pyrrolidine - Carbamic acid ester - Guanidine - Silyl ether - Oxirane - Organoheterosilane - Oxacycle - Azacycle - Organic metalloid salt - Organoheterocyclic compound - Carboximidamide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic metalloid moeity - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic oxide - Organosilicon compound - Imine - Hydrocarbon derivative - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as saxitoxins, gonyautoxins, and derivatives. These are compounds with a structure based on a 2,6-diamino-4-methyl-pyrrolo[1,2-c]purin-10-ol skeleton.
External Descriptors
Not available