Coclaurine

CAS Registry Number®

486-39-5

CAS Name

Coclaurine

Molecular Formula

C17H19NO3

Molecular Mass

285.34

Cite this Page

Coclaurine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=486-39-5 (retrieved 2024-11-21) (CAS RN: 486-39-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    220 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C17H19NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,18-20H,6-8H2,1H3/t15-/m0/s1

InChIKey

InChIKey=LVVKXRQZSRUVPY-HNNXBMFYSA-N

SMILES

C([C@H]1C=2C(=CC(OC)=C(O)C2)CCN1)C3=CC=C(O)C=C3

Canonical SMILES

OC1=CC=C(C=C1)CC2NCCC3=CC(OC)=C(O)C=C32

Other Names for this Substance

  • 7-Isoquinolinol, 1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-, (1S)-
  • Coclaurine
  • 7-Isoquinolinol, 1,2,3,4-tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-, (S)-
  • (1S)-1,2,3,4-Tetrahydro-1-[(4-hydroxyphenyl)methyl]-6-methoxy-7-isoquinolinol
  • (S)-1-(p-Hydroxybenzyl)-6-methoxy-7-hydroxy-1,2,3,4-tetrahydroisoquinoline

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration