Heroin

Synonyms: Diacetylmorphine, "Diamorphine", "3,6-Diacetylmorphine", "Acetomorphine", "O,O'-Diacetylmorphine", "Morphacetin", "Diaphorm", "Preza", "Morphine diacetate", "Diasetilmorfin", "Acetomorfine", "Diacetylmorfin", "Diamorfina", "Diacephin", "Iroini", "Heroiin", "Herolan", "Persian", "Aspron", "Heroien", "Eroina", "Dujie", "Smack", "Diasetylmorfiimi", "Diasetielmorfien", "Dooje", "Diazetylmorphine", "Stuff", "Junk", "Scot", "Amsterdam Marble", "Diacetyl morphine", "3,6-O-Diacetylmorphine", "Harry", "Rufus", "Horse", "Hairy", "Crap", "White stuff", "Persian brown", "White junk", "Mexican Brown", "Malaysian"

Source: Heroin is a highly addictive, illegal drug.

Identifiers:

IUPAC Name: [(4R,4aR,7S,7aR,12bS)-9-acetyloxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl] acetate
CAS Number: 561-27-3
PubChem ID: 5462328
InChiKey: GVGLGOZIDCSQPN-PVHGPHFFSA-N
Canonical SMILES: CC(=O)OC1C=CC2C3CC4=C5C2(C1OC5=C(C=C4)OC(=O)C)CCN3C

Structural Properties:

Molecular Formula: C₂₁H₂₃NO₅
Molecular Weight: 369,400

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 6
Number of atoms different from hydrogen: 27

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Evidence Supporting This Chemical as an Emerging Contaminant

Banjac, Z., Ginebreda, A., Kuzmanovic, M., Marc?, R., Nadal, M., Riera, J. M., & Barcel?, D. (2015). Emission factor estimation of ca. 160 emerging organic microcontaminants by inverse modeling in a Mediterranean river basin (Llobregat, NE Spain). Science of the Total Environment, 520, 241-252.

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