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Product Code

TRC-I781010

CAS Number

1048360-09-3

Product Format

Neat

Molecular Formula

C25H32INO5

Molecular Weight

553.43

Price and availability

48-hour USA dispatch time
Freight restricted.

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Product Information

Chemical Data

Analyte Name

O-Isobutyryl N-Methyl Naltrexone Iodide

CAS Number

1048360-09-3

Molecular Formula

C25H32INO5

Molecular Weight

553.43

Accurate Mass

553.1325

SMILES

[I-].CC(C)C(=O)Oc1ccc2C[C@@H]3[C@]4(O)CCC(=O)[C@@H]5Oc1c2[C@]45CC[N+]3(C)CC6CC6

InChI

InChI=1S/C25H32NO5.HI/c1-14(2)23(28)30-18-7-6-16-12-19-25(29)9-8-17(27)22-24(25,20(16)21(18)31-22)10-11-26(19,3)13-15-4-5-15;/h6-7,14-15,19,22,29H,4-5,8-13H2,1-3H3;1H/q+1;/p-1/t19-,22+,24+,25-,26?;/m1./s1

IUPAC

[(4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a-hydroxy-3-methyl-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-3-ium-9-yl] 2-methylpropanoate;iodide

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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