Nicocodine

CAS Registry Number®

3688-66-2

CAS Name

Nicocodine

Molecular Formula

C24H24N2O4

Molecular Mass

404.46

Cite this Page

Nicocodine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3688-66-2 (retrieved 2024-11-22) (CAS RN: 3688-66-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C24H24N2O4/c1-26-11-9-24-16-6-8-19(29-23(27)15-4-3-10-25-13-15)22(24)30-21-18(28-2)7-5-14(20(21)24)12-17(16)26/h3-8,10,13,16-17,19,22H,9,11-12H2,1-2H3/t16-,17+,19-,22-,24-/m0/s1

InChIKey

InChIKey=RYBGRHAWFUVMST-MJFIPZRTSA-N

SMILES

O(C(=O)C=1C=CC=NC1)[C@@H]2[C@]3([C@]45C=6C(O3)=C(OC)C=CC6C[C@]([C@@]4(C=C2)[H])(N(C)CC5)[H])[H]

Canonical SMILES

O=C(OC1C=CC2C3N(C)CCC42C5=C(OC14)C(OC)=CC=C5C3)C=6C=NC=CC6

Other Names for this Substance

  • Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, 6-(3-pyridinecarboxylate), (5α,6α)-
  • Morphinan-6α-ol, 7,8-didehydro-4,5α-epoxy-3-methoxy-17-methyl-, nicotinate (ester)
  • Codeine nicotinate
  • Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, 3-pyridinecarboxylate (ester), (5α,6α)-
  • Nicotinic acid, 7,8-didehydro-4,5α-epoxy-3-methoxy-17-methylmorphinan-6α-yl ester

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration