Acetyl cedrene

Synonyms: Acetyl cedrene

Source: Acetyl cedrene is a member of the fragrance structural group Alkyl Cyclic Ketones.

Identifiers:

IUPAC Name: (1Z)-1-[(1R,8S)-6,6,8-trimethyl-2-tricyclo[5.3.1.01,5]undecanylidene]propan-2-one
CAS Number: n/a
PubChem ID: 91746703
InChiKey: WXETUDXXEZHSCS-JUBVSGQUSA-N
Canonical SMILES: CC1CCC23CC1C(C2CCC3=CC(=O)C)(C)C

Structural Properties:

Molecular Formula: C₁₇H₂₆O
Molecular Weight: 246,400

Pharmacophore Features:

Number of bond donors: 0
Number of bond acceptors: 1
Number of atoms different from hydrogen: 18

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2D structure (.sdf)
3D structure (.sdf)
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Evidence Supporting This Chemical as an Emerging Contaminant

Terzi?, S., Senta, I., Ahel, M., Gros, M., Petrovi?, M., Barcelo, D., ... & Jovan?i?, P. (2008). Occurrence and fate of emerging wastewater contaminants in Western Balkan Region. Science of the total environment, 399(1-3), 66-77.

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2D-structure

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