Products for Research Use Only
RegisterLogin

Neoechinulin C

CAT: 0804-HY-N10283Size: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-N10283Size:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Neoechinulin C, an echinulin-related indolediketopiperazine alkaloid, protects the neuronal cells against paraquat-induced damage in a Parkinson’s disease model[1].
CAS Number
55179-54-9
UNSPSC
12352005
Target
Endogenous Metabolite
Type
Natural Products
Related Pathways
Metabolic Enzyme/Protease
Applications
Neuroscience-Neurodegeneration
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/neoechinulin-c.html
Solubility
10 mM in DMSO
Smiles
C=CC(C)(C)C1=C(C2=CC=C(C/C=C(C)\C)C=C2N1)/C=C3C(NC(C(N/3)=O)=C)=O
Molecular Formula
C24H27N3O2
Molecular Weight
389.49
References & Citations
[1]Smetanina OF, et al. Biologically Active Echinulin-Related Indolediketopiperazines from the Marine Sediment-Derived Fungus Aspergillus niveoglaucus. Molecules. 2019;25 (1) :61. Published 2019 Dec 23.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported
Isoform
Microbial Metabolite

Chemical Information

Cryptoechinuline A

Neoechinulin C is a member of indoles.

CAS Number55179-54-9
PubChem CID23425628
IUPAC Name(3Z)-3-[[2-(2-methylbut-3-en-2-yl)-6-(3-methylbut-2-enyl)-1H-indol-3-yl]methylidene]-6-methylidenepiperazine-2,5-dione
Molecular FormulaC24H27N3O2
Molecular Weight389.5
XLogP5.5
Topological Polar Surface Area74
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count29
Formal Charge0
Complexity773
SMILES
CC(=CCC1=CC2=C(C=C1)C(=C(N2)C(C)(C)C=C)/C=C\3/C(=O)NC(=C)C(=O)N3)C
InChI
InChI=1S/C24H27N3O2/c1-7-24(5,6)21-18(13-20-23(29)25-15(4)22(28)27-20)17-11-10-16(9-8-14(2)3)12-19(17)26-21/h7-8,10-13,26H,1,4,9H2,2-3,5-6H3,(H,25,29)(H,27,28)/b20-13-
InChIKey
WXWNIBJUIDHOOC-MOSHPQCFSA-N
Chemical Structure
2D Structure
2D structure of Cryptoechinuline A
CAS: 55179-54-9
CID: 23425628
Formula: C24H27N3O2
MW: 389.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight389.5
XLogP35.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass389.21032711
Monoisotopic Mass389.21032711
Topological Polar Surface Area74 Ų
Heavy Atom Count29
Formal Charge0
Complexity773
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-N3204Neoechinulin A
HY-140336-01C-NH-Boc-C-Bis- (C-PEG1-Boc)
HY-138383CHO-C-PEG2-C-CHO
HY-168132Thalidomide-NH-C-C6H10-C-acid
HY-161974Adamantan-C-amide-PEG2-C-Br
HY-W382140-014′-C-Fluoro-2′-C-methyluridine
HY-178831Azacyclohexane-C-piperazine-C (OCH3) 2
HY-161210Thalidomide-azetidine-C-PIP-C-boc
HY-P11336Oscillamide C
HY-P11086C (R3W4V)

Alternative Products

CatalogName
MBS5762832Neoechinulin A
MBS5790172Neoechinulin B
T75469-01Neoechinulin C
MBS5790122Neoechinulin D
MBS5790120Neoechinulin E

Popular Products