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Product Overview

Product Code

TRC-M652325

CAS Number

151250-15-6

Product Format

Neat

Molecular Formula

C30H35NO12

Molecular Weight

601.6

Product Categories

Additional Neuro Products, TRC, Opiate and Opioid Reference Materials , Pharmaceutical Toxicology Reference Materials

Product Type

Bioactive small molecule, Impurity

Documentation

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Product Information

Chemical Data

Analyte Name

Morphine 3-(Tri-O-acetyl-beta-D-glucuronide) Methyl Ester

CAS Number

151250-15-6

Molecular Formula

C30H35NO12

Molecular Weight

601.6

Accurate Mass

601.2159

SMILES

COC(=O)[C@H]1O[C@@H](Oc2ccc3C[C@H]4[C@@H]5C=C[C@H](O)[C@@H]6Oc2c3[C@]56CCN4C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1OC(=O)C

InChI

InChI=1S/C30H35NO12/c1-13(32)38-23-24(39-14(2)33)26(40-15(3)34)29(43-25(23)28(36)37-5)41-20-9-6-16-12-18-17-7-8-19(35)27-30(17,10-11-31(18)4)21(16)22(20)42-27/h6-9,17-19,23-27,29,35H,10-12H2,1-5H3/t17-,18-,19-,23-,24-,25-,26+,27-,29+,30-/m0/s1

IUPAC

methyl (2S,3S,4S,5R,6S)-6-[[(4S,4aR,7S,7aR,12bS)-7-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-9-yl]oxy]-3,4,5-triacetyloxyoxane-2-carboxylate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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