Registration Dossier
Registration Dossier
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EC number: 240-326-2 | CAS number: 16196-82-0
Reference substances
- IUPAC name:
- 1-[(1S,2R,6S,14R,15R,16S)-11,15-dimethoxy-3-methyl-13-oxa-3-azahexacyclo[13.2.2.1^{2,8}.0^{1,6}.0^{6,14}.0^{7,12}]icosa-7,9,11-trien-16-yl]ethan-1-one
Inventory
- EC number:
- 240-326-2
- EC name:
- 1-[(5α,7α)-4,5-epoxy-18,19-dihydro-3,6-dimethoxy-17-methyl-6,14-ethenomorphinan-7-yl]ethanone
- CAS number:
- 16196-82-0
- CAS number:
- 16196-82-0
Synonyms
- Names:
- 1-[(5alpha,7alpha)-4,5-epoxy-18,19-dihydro-3,6-dimethoxy-17-methyl-6,14-ethenomorphinan-7-yl]ethanone
- Identifier:
- IUPAC name
- 1-(4,5α-epoxy-3,6-dimethoxy-17-methyl-6α,14-ethano-14α-morphinan-7α-yl)-1-oxoethane
- Identifier:
- IUPAC name
- 1-[(5a,7a)-4,5-epoxy-18,19-dihydro-3,6-dimethoxy-17-methyl-6,14-ethenomorphinan-7-yl]ethanone
- Identifier:
- IUPAC name
- 1-[(5α,7α)-4,5-epoxy-18,19-dihydro-3,6-dimethoxy-17-methyl-6,14-ethenomorphinan-7-yl]ethanone
- Identifier:
- other: SMILES notation
- CC(=O)[C@H]1C[C@@]23CC[C@@]1([C@H]4[C@@]25CCN([C@@H]3Cc6c5c(c(cc6)OC)O4)C)OC
- Identifier:
- other: SMILES notation
- COc1ccc2CC(N3C)C45CC(C(=O)C)C(OC)(CC5)C6Oc1c2C46CC3
- Identifier:
- other: SMILES notation
- COc1ccc2CC3N(C)CCC45C(Oc1c24)C6(CCC35CC6C(=O)C)OC
- Identifier:
- other: InChl
- InChI=1S/C23H29NO4/c1-13(25)15-12-21-7-8-23(15,27-4)20-22(21)9-10-24(2)17(21)11-14-5-6-16(26-3)19(28-20)18(14)22/h5-6,15,17,20H,7-12H2,1-4H3
- 1-(3,6-dimethoxy-17-methyl-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-7-yl)ethanone
Molecular and structural information
- Molecular formula:
- C23H29NO4
- Molecular weight:
- 383.481
- SMILES notation:
- COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@]6(CC[C@@]35C[C@@H]6C(=O)C)OC
- InChl:
- InChI=1/C23H29NO4/c1-13(25)15-12-21-7-8-23(15,27-4)20-22(21)9-10-24(2)17(21)11-14-5-6-16(26-3)19(28-20)18(14)22/h5-6,15,17,20H,7-12H2,1-4H3
- Structural formula:
Related substances
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