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67767-19-5

67767-19-5 | 9H-Pyrido[3,4-b]indol-6-ol, 1-methyl-

CAS No: 67767-19-5 Catalog No: AG005Q8X MDL No:MFCD01548425

Product Description

Catalog Number:
AG005Q8X
Chemical Name:
9H-Pyrido[3,4-b]indol-6-ol, 1-methyl-
CAS Number:
67767-19-5
Molecular Formula:
C12H10N2O
Molecular Weight:
198.2206
MDL Number:
MFCD01548425
IUPAC Name:
1-methyl-9H-pyrido[3,4-b]indol-6-ol
InChI:
InChI=1S/C12H10N2O/c1-7-12-9(4-5-13-7)10-6-8(15)2-3-11(10)14-12/h2-6,14-15H,1H3
InChI Key:
QMMOFTKCULGVPS-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)c1ccnc(c1[nH]2)C

Properties

Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.079g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
198.225g/mol
Monoisotopic Mass:
198.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

Literature

Title Journal
Oxidative metabolism of the bioactive and naturally occurring beta-carboline alkaloids, norharman and harman, by human cytochrome P450 enzymes. Chemical research in toxicology 20081101
Indolealkylamines: biotransformations and potential drug-drug interactions. The AAPS journal 20080601
6-Hydroxy- and 6-methoxy-beta-carbolines as acetyl- and butyrylcholinesterase inhibitors. Bioorganic & medicinal chemistry letters 20061115
Microbial metabolites of harman alkaloids. Chemical & pharmaceutical bulletin 20030601
Beta-carboline alkaloids from a New Zealand marine bryozoan, Cribricellina cribraria. Natural product research 20030101

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