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SH-BC-893

CAT: 0804-HY-124758-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-124758-01Size:1 mg
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Description
SH-BC-893 is an orally active anti-neoplastic sphingolipid analog. SH-BC-893 also protects from ceramide-induced mitochondrial dysfunction and corrects diet-induced obesity. SH-BC-893 can be used for the research of cancer and obesity[1][2].
CAS Number
1841409-92-4
UNSPSC
12352005
Target
Mitochondrial Metabolism
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-sugar/lipid metabolism
Field of Research
Cancer; Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/sh-bc-893.html
Purity
98.03
Solubility
DMSO : 50 mg/mL (ultrasonic)
Smiles
OC[C@H]1NCC[C@@H]1C2=CC=C(CCCCCCCC)C=C2.Cl
Molecular Formula
C19H32ClNO
Molecular Weight
325.92
References & Citations
[1]Kubiniok, Peter et al. Dynamic Phosphoproteomics Uncovers Signaling Pathways Modulated by Anti-oncogenic Sphingolipid Analogs. Molecular & cellular proteomics : MCP vol. 18,3 (2019) : 408-422. |[2]Jayashankar, Vaishali et al. Drug-like sphingolipid SH-BC-893 opposes ceramide-induced mitochondrial fission and corrects diet-induced obesity. EMBO molecular medicine vol. 13,8 (2021) : e13086.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C (Powder, sealed storage, away from moisture)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

CID 155512882
CAS Number1841409-92-4
PubChem CID155512882
IUPAC Name[(2S,3R)-3-(4-octylphenyl)pyrrolidin-2-yl]methanol;hydrochloride
Molecular FormulaC19H32ClNO
Molecular Weight325.9
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Heavy Atom Count22
Formal Charge0
Complexity260
SMILES
CCCCCCCCC1=CC=C(C=C1)[C@H]2CCN[C@@H]2CO.Cl
InChI
InChI=1S/C19H31NO.ClH/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)18-13-14-20-19(18)15-21;/h9-12,18-21H,2-8,13-15H2,1H3;1H/t18-,19-;/m1./s1
InChIKey
QJRPLIVTEDTSKX-STYNFMPRSA-N
Chemical Structure
2D Structure
2D structure of CID 155512882
CAS: 1841409-92-4
CID: 155512882
Formula: C19H32ClNO
MW: 325.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight325.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Exact Mass325.2172423
Monoisotopic Mass325.2172423
Topological Polar Surface Area32.3 Ų
Heavy Atom Count22
Formal Charge0
Complexity260
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes