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CAS Number: 42438-90-4
(S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid

Structure

(S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
Name: (S)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
Synonyms:
General Information
Product Number: 42438904
CAS Registry Number: 42438-90-4
Name:
1H-​Pyrido[3,​4-​b]​indole-​3-​carboxylic acid, 2,​3,​4,​9-​tetrahydro-​, (3S)​-
1H-​Pyrido[3,​4-​b]​indole-​3-​carboxylic acid, 2,​3,​4,​9-​tetrahydro-​, (S)​-; (-​)​-​(3S)​-​1,​2,​3,​4-​Tetrahydro-​β-​carboline-​3-​carboxylic acid; (S)​-​(-​)​-​2,​3,​4,​9-​Tetrahydro-​1H-​pyrido[3,​4-​b]​indole-​3-​carboxylic acid; (S)​-​1,​2,​3,​4-​Tetrahydro-​3-​carboxy-​2-​carboline; L-​1,​2,​3,​4-​Tetrahydro-​3-​carboxy-​2-​carboline; L-​3-​Carboxy-​1,​2,​3,​4-​tetrahydro-​β-​carboline; Lycoperodine-​1 
 
Chemical Formula: C12H12N2O2
Exact Mass: 216.09
Molecular Weight: 216.24
m/z: 216.09 (100.0%), 217.09 (13.8%)
Elemental Analysis: C, 66.65; H, 5.59; N, 12.96; O, 14.80
 
InChI: InChI=1S/C12H12N2O2/c15-12(16)10-5-8-7-3-1-2-4-9(7)14-11(8)6-13-10/h1-4,10,13-14H,5-6H2,(H,15,16)/t10-/m0/s1
InChIKey: FSNCEEGOMTYXKY-JTQLQIEISA-N
Canonical SMILES : C1C(NCC2=C1C3=CC=CC=C3N2)C(=O)O
Isomeric SMILES: C1[C@H](NCC2=C1C3=CC=CC=C3N2)C(=O)O
 
Thermal Properties Value Condition Note
Melting Point 312-313 °C Solv: water (7732-18-5) (8)CAS
Melting Point 308-311 °C   (1)CAS
Melting Point 308-311 °C   (2)CAS
Melting Point 280-282 °C   (10)CAS
Melting Point 280-282 °C   (4)CAS
Melting Point 280-282 °C   (5)CAS

Specification

98%

References
  1. (1) Li, Guo-qiang; Journal of Chinese Pharmaceutical Sciences 2004, V13(2), P81-86 CAPLUS
  2. (2) Li, Liya; Beijing Daxue Xuebao, Yixueban 2004, V36(1), P12-17 CAPLUS
  3. (3) Yahara, Shoji; Journal of Natural Products 2004, V67(3), P500-502 CAPLUS
  4. (4) Li, Li; Journal of Physical Chemistry B 2008, V112(38), P12139-12147 CAPLUS
  5. (5) Zhao, Ming; Bioorganic & Medicinal Chemistry 2006, V14(14), P4761-4774 CAPLUS
  6. (6) Wu, Guofeng; Tetrahedron 2007, V63(25), P5510-5528 CAPLUS
  7. (7) Liu, Jiawang; Journal of Medicinal Chemistry 2010, V53(8), P3106-3116 CAPLUS
  8. (8) Choudhary, A. N.; Journal of Young Pharmacists 2011, V3(2), P132-137 CAPLUS
  9. (9) Bi, Wei; European Journal of Medicinal Chemistry 2011, V46(6), P2441-2452 CAPLUS
  10. (10) Zhao, Ming; Preparative Biochemistry & Biotechnology 2004, V34(1), P57-76 CAPLUS
  11. (11) Peng, Shiqi; US 20050080015 A1 2005 CAPLUS
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