Fumigaclavine B

CAS Registry Number®

6879-93-2
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CAS Name

Fumigaclavine B

Molecular Formula

C16H20N2O

Molecular Mass

256.34

Cite this Page

Fumigaclavine B.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6879-93-2 (retrieved 2024-04-30) (CAS RN: 6879-93-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    265-267 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H20N2O/c1-9-8-18(2)13-6-10-7-17-12-5-3-4-11(14(10)12)15(13)16(9)19/h3-5,7,9,13,15-17,19H,6,8H2,1-2H3/t9-,13-,15-,16+/m1/s1

InChIKey

InChIKey=JUXRVSRUBIFVKE-BBDZHYCFSA-N

SMILES

O[C@@H]1[C@@]2(C=3C=4C(C[C@]2(N(C)C[C@H]1C)[H])=CNC4C=CC3)[H]

Canonical SMILES

OC1C2C=3C=CC=C4NC=C(C43)CC2N(C)CC1C

Other Names for this Substance

  • Ergolin-9-ol, 6,8-dimethyl-, (8α,9β)-
  • Fumigaclavine B
  • Indolo[4,3-fg]quinoline, ergolin-9-ol deriv.
  • (8α,9β)-6,8-Dimethylergolin-9-ol

Deleted or Replaced CAS Registry Numbers

1381-32-4

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