Calligonine

CAS 525-40-6 MFCD00046879

化学结构图

525-40-6
SMILES: CC1NCCc2c1[nH]c1ccccc21

化学属性

Mol. FormulaC12H14N2
Mol. Weight186.257

别名和识别编码

Chemical NameCalligonine
Synonym (R,S)-1-Methyl-2,3,4,9-tetrahydro-1H-β-carboline 1,2,3,4-Tetrahydroharman 1,2,3,4-Tetrahydroharmane 1-methyl-1,2,3,4-tetrahydro--beta-carboline 1-methyl-2,3,4,9-tetrahydro-1H-β-carboline 1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-1-methyl- 2,3,4,9-Tetrahydro-1-methyl-1H-pyrido[3,4-b]indole 6-Methyltetrahydro-β-carboline DL-Eleagnin DL-Tetrahydroharman Harman, 1,2,3,4-tetrahydro- Methtryptoline Tetrahydroharman tetrahydroharman tetrahydroharmane tetrahydroharmane monohydrochloride tetrahydroharmane, (+-)-isomer tetrahydroharmane, (R)-isomer tetrahydroharmane, (S)-isomer tetrohydroharmane
InChIKeyLPIJOZBIVDCQTE-UHFFFAOYSA-N
PubChem Substance ID91522
InChIInChI=1S/C12H14N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-5,8,13-14H,6-7H2,1H3
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分类

  • {uni_hamburg} no charge; nitrogen heterocycle; carbocycle; aromatic; alicycle; large ring; fused rings; 5ring; 6ring; 9ring; 13ring; racemate; 1fragment

相关文献及参考

  • Short: III/35B Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Fluorine-19 and Nitrogen-15 Author: Balasubramanian, M.; Gupta, R.R.; Jain, M.; Perumal, S. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35B Year: 1998 ISBN: 3-540-63275-1 ISBN: 978-3-540-63275-7 Internet Resource: DOI:10.1007/b55685 RefComment: VII, 242 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CO-ROM's.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

系列性分类

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