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Chemical structure of 6β-Hydromorphol

GC40891

6β-Hydromorphol

Also known as (4R,4aR,7R,7aR,12bS)-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol

6β-Hydromorphol is an analytical reference material that is structurally similar to known opioids

ChemicalCAS26626-12-0MW287.4FormulaC17H21NO3
CAS number
26626-12-0
Molecular weight
287.4
Formula
C17H21NO3
Solubility
DMF： 20 mg/ml,DMF：PBS(pH 7·2)(1：1)： 0·5 mg/ml,DMSO： 10 mg/ml
InChIKey
IJVCSMSMFSCRME-NOSXKOESSA-N
Catalogue number
GC40891
Brand
GLPBIO
Computed properties PubChem CID 9814448 · XLogP 1.8 · TPSA 52.9 Ų · H-bond donors 2
XLogP
1.8
TPSA
52.9 Ų
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
21

SMILES CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@@H](CC4)O

Computed descriptors from PubChem (CID 9814448), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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