Compound Identification
SMILES
NCCCC(O)(P(O)(O)=O)P(O)(O)=O.CN(CCN1CCOCC1)C1=NC(=CS1)C1=CC=C(OCCCCCOC2=CC=C(C=C2)C(\N)=N\O)C=C1
InChIKey
InChIKey=CRVQVLGLUDARBD-UHFFFAOYSA-N
Formula
C32H50N6O11P2S
Mass
788.79
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Organic phosphonic acids and derivatives
- Subclass Bisphosphonates
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Class
Organic phosphonic acids and derivatives
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Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic phosphonic acids and derivatives
Subclass
Bisphosphonates
Intermediate Tree Nodes
Not available
Direct Parent
Bisphosphonates
Alternative Parents
Phenoxy compounds Phenol ethers Dialkylarylamines 2,4-disubstituted thiazoles Alkyl aryl ethers 2-amino-1,3-thiazoles Morpholines Organic phosphonic acids Amidoximes Heteroaromatic compounds Trialkylamines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organophosphorus compounds
Molecular Framework
Not available
Substituents
Bisphosphonate - Phenoxy compound - Phenol ether - Dialkylarylamine - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Monocyclic benzene moiety - Morpholine - Oxazinane - Benzenoid - 1,3-thiazol-2-amine - Heteroaromatic compound - Thiazole - Amidoxime - Azole - Organophosphonic acid - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Oxacycle - Amidine - Azacycle - Dialkyl ether - Ether - Amine - Primary aliphatic amine - Organic oxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organophosphorus compound - Primary amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as bisphosphonates. These are organic compounds containing two phosphonate groups linked together through a carbon atoms.
External Descriptors
Not available