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A236

Sigma-Aldrich

AB-MECA

solid

Synonym(s):

N6-(4-Aminobenzyl)-9-[5-(methylcarbonyl)-β-D-ribofuranosyl]adenine, N6-(4-Aminobenzyl)-N-methylcarboxamidoadenosine

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About This Item

Empirical Formula (Hill Notation):
C18H21N7O4
CAS Number:
Molecular Weight:
399.40
MDL number:
UNSPSC Code:
12352200
PubChem Substance ID:
NACRES:
NA.77
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form

solid

Quality Level

color

off-white

solubility

45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: 0.3 mg/mL
ethanol: 1 mg/mL
DMSO: 10 mg/mL
dilute aqueous base: 3.5 mg/mL
H2O: insoluble

storage temp.

−20°C

SMILES string

CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n2cnc3c(NCc4ccc(N)cc4)ncnc23

InChI

1S/C18H21N7O4/c1-20-17(28)14-12(26)13(27)18(29-14)25-8-24-11-15(22-7-23-16(11)25)21-6-9-2-4-10(19)5-3-9/h2-5,7-8,12-14,18,26-27H,6,19H2,1H3,(H,20,28)(H,21,22,23)/t12-,13+,14-,18+/m0/s1

InChI key

LDYMCRRFCMRFKB-MOROJQBDSA-N

Gene Information

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U1128

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Quality Level

100

Quality Level

100

Quality Level

200

Quality Level

200

assay

≥98% (TLC)

assay

99%

assay

≥99% (HPLC)

assay

99%

form

powder

form

powder

form

powder

form

-

storage temp.

−20°C

storage temp.

-

storage temp.

room temp

storage temp.

-

solubility

1 M NaOH: 50 mg/mL, clear, colorless to faintly yellow

solubility

-

solubility

1 M NaOH: 50 mg/mL, clear to slightly hazy, colorless to faintly yellow

solubility

1 M NaOH: soluble 50 mg/mL, clear, colorless

Biochem/physiol Actions

High affinity A3 adenosine receptor agonist.

Legal Information

Sold under license from the National Institutes of Health.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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