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Key Documents

K1888

Sigma-Aldrich

K 185

solid

Synonym(s):

N-Butanoyl 2-(5,6,7-trihydro-11-methoxybenzo[c]cyclohept­[2,1-a]­indol-13-yl)ethanamine

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About This Item

Empirical Formula (Hill Notation):
C24H28N2O2
CAS Number:
Molecular Weight:
376.49
MDL number:
UNSPSC Code:
12352200
PubChem Substance ID:
NACRES:
NA.77

form

solid

color

white

solubility

DMSO: soluble 20 mg/mL

storage temp.

−20°C

SMILES string

CCCC(=O)NCCc1c2-c3ccccc3CCCn2c4ccc(OC)cc14

InChI

1S/C24H28N2O2/c1-3-7-23(27)25-14-13-20-21-16-18(28-2)11-12-22(21)26-15-6-9-17-8-4-5-10-19(17)24(20)26/h4-5,8,10-12,16H,3,6-7,9,13-15H2,1-2H3,(H,25,27)

InChI key

SPIFQXPRSJKRAO-UHFFFAOYSA-N

Gene Information

Biochem/physiol Actions

Melatonin receptor antagonist.

Features and Benefits

This compound is featured on the Melatonin Receptors page of the Handbook of Receptor Classification and Signal Transduction. To browse other handbook pages, click here.

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Storage Class

13 - Non Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves


Certificates of Analysis (COA)

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