Product Code

TRC-H281183

Product Format

Neat

Molecular Formula

C21 D6 H17 N O5

Molecular Weight

375.448

Product Categories

Opioid receptors, TRC, Neurotransmission, Depression, Memory, Learning and Cognition, Addiction, Pain and Inflammation, Stable isotopes, Opiate and Opioid Reference Materials

Product Type

Stable Isotope Labelled, API

Alternate CAS Number

561-27-3

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Heroin-d6

Molecular Formula

C21 D6 H17 N O5

Molecular Weight

375.448

Accurate Mass

375.195

SMILES

[2H]C1N([C@@H]2Cc3ccc(OC(=O)C)c4O[C@H]5[C@@H](OC(=O)C)C=C[C@@H]2[C@]5(c34)C1([2H])[2H])C([2H])([2H])[2H]

InChI

InChI=1S/C21H23NO5/c1-11(23)25-16-6-4-13-10-15-14-5-7-17(26-12(2)24)20-21(14,8-9-22(15)3)18(13)19(16)27-20/h4-7,14-15,17,20H,8-10H2,1-3H3/t14-,15+,17-,20-,21-/m0/s1/i3D3,8D2,9D/t9?,14-,15+,17-,20-,21-

IUPAC

[(4R,4aR,7S,7aR,12bS)-7-acetyloxy-1,1,2-trideuterio-3-(trideuteriomethyl)-2,4,4a,7,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl] acetate

Alternate CAS Number

561-27-3

SIL Type

Deuterium

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Heroin-d6

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