Products for Research Use Only
RegisterLogin

Mitraciliatine

CAT: 0931-T83913-01Size: 500 µgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-T83913-01Size:500 µg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
14509-92-3
Target
Others
Related Pathways
Others
Bioactivity
Mitraciliatine, an alkaloid discovered in M. speciosa (Kratom in Thai), acts as a partial agonist for the μ-opioid receptor (MOR) and an agonist for the κ-opioid receptor (KOR), demonstrating selectivity for these receptors over the δ-opioid receptor (DOR) with EC50 values of 228, 218, and >1,000 nM respectively in mouse receptors through a GTPγS binding assay. When administered intracerebroventricularly (i.c.v.) at 100 nmol/animal, mitraciliatine increases latency to withdrawal in the warm water tail withdrawal assay in mice, an effect reversable by MOR knockout but unaffected by KOR knockout, distinguishing it from morphine by not causing hyperlocomotion or respiratory depression.
Smiles
COC1=C2C3=C(NC2=CC=C1)[C@]4([H])N(C[C@@H]([C@H](C4)/C(C(OC)=O)=C\OC)CC)CC3
Molecular Formula
C23H30N2O4
Molecular Weight
398.5
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Mitraciliatine

Mitraciliatine is a monoterpenoid indole alkaloid with formula C23H30N2O4. It is isolated from the plant Mitragyna speciosa. It has a role as a plant metabolite. It is a methyl ester, an organic heterotetracyclic compound, an enol ether and a monoterpenoid indole alkaloid.

CAS Number14509-92-3
PubChem CID11741588
IUPAC Namemethyl (E)-2-[(2S,3R,12bR)-3-ethyl-8-methoxy-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate
Molecular FormulaC23H30N2O4
Molecular Weight398.5
XLogP3.4
Topological Polar Surface Area63.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count29
Formal Charge0
Complexity624
SMILES
CC[C@H]1CN2CCC3=C([C@H]2C[C@@H]1/C(=C\OC)/C(=O)OC)NC4=C3C(=CC=C4)OC
InChI
InChI=1S/C23H30N2O4/c1-5-14-12-25-10-9-15-21-18(7-6-8-20(21)28-3)24-22(15)19(25)11-16(14)17(13-27-2)23(26)29-4/h6-8,13-14,16,19,24H,5,9-12H2,1-4H3/b17-13+/t14-,16-,19+/m0/s1
InChIKey
LELBFTMXCIIKKX-CGJCNEAHSA-N
Chemical Structure
2D Structure
2D structure of Mitraciliatine
CAS: 14509-92-3
CID: 11741588
Formula: C23H30N2O4
MW: 398.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight398.5
XLogP33.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass398.22055744
Monoisotopic Mass398.22055744
Topological Polar Surface Area63.8 Ų
Heavy Atom Count29
Formal Charge0
Complexity624
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
GTR19219815-01Mitraciliatine

Popular Products