LX2931 - Moligand™ , Inhibitor of sphingosine-1-phosphate lyase 1, CAS No.L611629, Inhibitor of sphingosine-1-phosphate lyase 1

CAS: L611629 Cat. No.: L611629 PubChem CID: 136034475

GRADE & PURITY Moligand™

Synonyms

LX3305

Storage

Room temperature

Specifications

Synonyms

LX3305

Specifications & Purity

Moligand™

Storage

Room temperature

Grade

Moligand™

Action Type

INHIBITOR

Mechanism of action

Inhibitor of sphingosine-1-phosphate lyase 1

Names and Identifiers

• Canonical Smiles: C/C(=c/1\[nH]c(c[nH]1)[C@H]([C@@H]([C@@H](CO)O)O)O)/N=O
• IUPAC Name: (1R,2S,3R)-1-[(2E)-2-(1-nitrosoethylidene)-1,3-dihydroimidazol-4-yl]butane-1,2,3,4-tetrol
• InChIKey: CGJLPLVZAAEKTK-LIVYHJONSA-N
• INCHI: 1S/C9H15N3O5/c1-4(12-17)9-10-2-5(11-9)7(15)8(16)6(14)3-13/h2,6-8,10-11,13-16H,3H2,1H3/b9-4+/t6-,7-,8-/m1/s1
• PubChem CID: 136034475

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Sugar alcohols
• Alternative Parents: Monosaccharides Imidazolines Secondary alcohols Propargyl-type 1,3-dipolar organic compounds Polyols Enamines C-nitroso compounds Azacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Monosaccharide - Sugar alcohol - 4-imidazoline - Secondary alcohol - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Polyol - Organic nitroso compound - Enamine - C-nitroso compound - Organic oxide - Alcohol - Primary alcohol - Organonitrogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as sugar alcohols. These are hydrogenated forms of carbohydrate in which the carbonyl group (aldehyde or ketone, reducing sugar) has been reduced to a primary or secondary hydroxyl group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

SGPL1 Tchem Sphingosine-1-phosphate lyase 1 (1 Activities)

Discover Target: SGPL1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)