Speciociliatine

CAS: 14382-79-7

Ref. TR-S680100

Product Information

• Name: Speciociliatine
• Synonyms: Corynan-16-carboxylic acid, 16,17-didehydro-9,17-dimethoxy-, methyl ester, (3ß,16E,20ß)-, Speciociliatin, Indolo[2,3-a]quinolizine-2-acetic acid, 3-ethyl-1,2,3,4,6,7,12,12b-octahydro-8-methoxy-a-(methoxymethylene)-, methyl ester, (aE,2S,3S,12bR)-,17,18-Seco-3ß,20a-yohimban-16-carboxylic acid, 16,17-didehydro-9,17-dimethoxy-, methyl ester, (E)- (8CI), 17,18-Seco-3b,20a-yohimban-16-carboxylic acid,16,17-didehydro-9,17-dimethoxy-, methyl ester, (E)- (8CI), 17,18-Seco-3β,20α-yohimban-16-carboxylic acid, 16,17-didehydro-9,17-dimethoxy-, methyl ester, (E)-, Corynan-16-carboxylic acid, 16,17-didehydro-9,17-dimethoxy-, methyl ester, (3b,16E,20b)-, Indolo[2,3-a]quinolizine-2-acetic acid, 3-ethyl-1,2,3,4,6,7,12,12b-octahydro-8-methoxy-α-(methoxymethylene)-, methyl ester, (αE,2S,3S,12bR)-

Description

Applications Speciociliatine is an epimer of Mitragynine (M373550). Speciociliatine is an indole alkaloid from Mitragyna speciosa used in natural medicine. Speciociliatine is a neurochemical with opioid agonistic activity.
References Kitajima, M. et al.: J. Nat. Med., 60, 28 (2006); Horie, S. et al.: Planta Med., 71, 231 (2005); Takayama, H. et al.: J. Med. Chem., 45, 1949 (2002);

• Brand: TRC

Chemical properties

• Molecular weight: 398.50
• Formula: C₂₃H₃₀N₂O₄
• Color/Form: Neat
• 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-/m1/s1
• InChI key: InChIKey=LELBFTMXCIIKKX-MYLQJJOTSA-N
• SMILES: CC[C@@H]1CN2CCc3c([nH]c4cccc(OC)c34)[C@H]2C[C@@H]1/C(=C\OC)C(=O)OC