Name: Name:2,3,4,9-Tetrahydro-1h-b-carboline-3-carboxylic acid methyl ester
Brand: Angene
SKU: AG00APNP
Rating: 90 (10 reviews)

2,3,4,9-Tetrahydro-1h-b-carboline-3-carboxylic acid methyl ester

CAS No.:

16253-64-8

Catalog Number:

AG00APNP

Molecular Formula:

C13H14N2O2

Molecular Weight:

230.2625

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Purity

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Product Description

Catalog Number:

AG00APNP

Chemical Name:

2,3,4,9-Tetrahydro-1h-b-carboline-3-carboxylic acid methyl ester

CAS Number:

16253-64-8

Molecular Formula:

C13H14N2O2

Molecular Weight:

230.2625

MDL Number:

MFCD00642923

IUPAC Name:

methyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate

InChI:

InChI=1S/C13H14N2O2/c1-17-13(16)11-6-9-8-4-2-3-5-10(8)15-12(9)7-14-11/h2-5,11,14-15H,6-7H2,1H3

InChI Key:

QZGCHMZBGHVZFB-UHFFFAOYSA-N

SMILES:

COC(=O)[C@H]1NCc2c(C1)c1ccccc1[nH]2

Properties

Complexity:

308

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.267g/mol

Monoisotopic Mass:

230.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4

Literature

Title	Journal
Cytotoxic and insecticidal activities of derivatives of harmine, a natural insecticidal component isolated from Peganum harmala.	Molecules (Basel, Switzerland) 20101102
New tetracyclic tetrahydro-beta-carbolines as tryptophan-derived peptidomimetics.	Molecular diversity 20100201
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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