Basic Description

Specifications & Purity	Moligand™
Grade	Moligand™
Action Type	INHIBITOR
Mechanism of action	Inhibitor of delta 4-desaturase; sphingolipid 1

Associated Targets(Human)

DEGS1 Tchem Sphingolipid delta(4)-desaturase DES1 (1 Activities)

Discover Target: DEGS1

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

UGCG Tclin Ceramide glucosyltransferase (308 Activities)

Discover Target: UGCG

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

GBA1 Tclin Beta-glucocerebrosidase (14647 Activities)

Discover Target: GBA1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SMPD1 Tchem Sphingomyelin phosphodiesterase (13561 Activities)

Discover Target: SMPD1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

A549 (127892 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HCT-116 (91556 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

ASAH1 Tchem Acid ceramidase (411 Activities)

Discover Target: ASAH1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

DEGS1 Tchem Sphingolipid delta(4)-desaturase DES1 (28 Activities)

Discover Target: DEGS1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	N-[(E,2R)-1-hydroxy-4-tridecylsulfanylbut-3-en-2-yl]octanamide
INCHI	InChI=1S/C25H49NO2S/c1-3-5-7-9-10-11-12-13-14-16-18-21-29-22-20-24(23-27)26-25(28)19-17-15-8-6-4-2/h20,22,24,27H,3-19,21,23H2,1-2H3,(H,26,28)/b22-20+/t24-/m1/s1
InChi Key	NYZFADNSXWSJDZ-PPEFQKSUSA-N
Canonical SMILES	CCCCCCCCCCCCCS/C=C/[C@@H](NC(=O)CCCCCCC)CO
Isomeric SMILES	CCCCCCCCCCCCCS/C=C/[C@H](CO)NC(=O)CCCCCCC
PubChem CID	60150550

Database links

PubChem CID	60150550
ChEMBL Ligand	CHEMBL2024680
BindingDB Ligand	50382314

Certificates

Certificate of Analysis(COA)

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References

1. Camacho L, Simbari F, Garrido M, Abad JL, Casas J, Delgado A, Fabriàs G. (2012) 3-Deoxy-3,4-dehydro analogs of XM462. Preparation and activity on sphingolipid metabolism and cell fate.. Bioorg Med Chem, 20 (10): (3173-9). [PMID:22537678] [10.1021/op500134e]

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SKU	Size	Availability	Price	Qty
R613111-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,334.90
R613111-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,000.90

RBM2-1B , CAS No.R613111, Inhibitor of delta 4-desaturase; sphingolipid 1