δ-Carboline

CAT: 0804-HY-59024-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-59024-01Size:250 mg

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Description

δ-Carboline is a nitrogen-containing heterocyclic compound, and its derivatives all exhibit anti-cancer and antibacterial activities[1][2].

CAS Number

245-08-9

UNSPSC

12352005

Hazard Statement

H301

Target

Drug Intermediate

Related Pathways

Others

Field of Research

Cancer; Infection

Purity

99.92

Smiles

C12=CC=CN=C1C3=C(C=CC=C3)N2

Molecular Formula

C11H8N2

Molecular Weight

168.19

Precautions

H301

References & Citations

[1]Ayyamperumal S, et al. Molecular docking analysis of α-Topoisomerase II with δ-Carboline derivatives as potential anticancer agents. Bioinformation. 2021 Jan 31;17 (1) :249-265.|[2]Mazu TK, et al. δ-Carbolines and their ring-opened analogs: synthesis and evaluation against fungal and bacterial opportunistic pathogens. Eur J Med Chem. 2011 Jun;46 (6) :2378-85.

Shipping Conditions

Room Temperature

Storage Conditions

Store at room temperature 3 years

Scientific Category

Reference compound2

Clinical Information

No Development Reported

Chemical Information

5H-Pyrido(3,2-b)indole

CAS Number	245-08-9
PubChem CID	6451402
IUPAC Name	5H-pyrido[3,2-b]indole
Molecular Formula	C11H8N2
Molecular Weight	168.19
XLogP	2.4
Topological Polar Surface Area	28.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	13
Formal Charge	0
Complexity	193

SMILES

C1=CC=C2C(=C1)C3=C(N2)C=CC=N3

InChI

InChI=1S/C11H8N2/c1-2-5-9-8(4-1)11-10(13-9)6-3-7-12-11/h1-7,13H

InChIKey

NSBVOLBUJPCPFH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 245-08-9

CID: 6451402

Formula: C11H8N2

MW: 168.19

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	168.19
XLogP3	2.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	168.068748264
Monoisotopic Mass	168.068748264
Topological Polar Surface Area	28.7 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	193
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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005631	α-Carboline
FC19715-01	A-Carboline
167317	δ-Carboline
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GTR19274473-01	β-carboline-ACS81
TRC-C176595-500MG	delta-Carboline
005632	α-Carboline-15N2
MBS6028223-01	alpha-Carboline
TN7072-01	1-Ethoxycarbonyl-β-carboline
TN2524	1-Acetyl-β-carboline

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Chemical Information

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