(-)-Agroclavine

CAS Registry Number®

548-42-5

CAS Name

(-)-Agroclavine

Molecular Formula

C16H18N2

Molecular Mass

238.33

Cite this Page

(-)-Agroclavine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=548-42-5 (retrieved 2024-11-22) (CAS RN: 548-42-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    198-203 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H18N2/c1-10-6-13-12-4-3-5-14-16(12)11(8-17-14)7-15(13)18(2)9-10/h3-6,8,13,15,17H,7,9H2,1-2H3/t13-,15-/m1/s1

InChIKey

InChIKey=XJOOMMHNYOJWCZ-UKRRQHHQSA-N

SMILES

CN1[C@]2([C@@](C=3C=4C(C2)=CNC4C=CC3)(C=C(C)C1)[H])[H]

Canonical SMILES

C=1C=C2NC=C3C2=C(C1)C4C=C(C)CN(C)C4C3

Other Names for this Substance

  • Ergoline, 8,9-didehydro-6,8-dimethyl-
  • Agroclavine
  • Indolo[4,3-fg]quinoline, ergoline deriv.
  • 8,9-Didehydro-6,8-dimethylergoline
  • Agroclavin

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