Aeroplysinin

CAS Registry Number®

28656-91-9

CAS Name

Aeroplysinin

Molecular Formula

C9H9Br2NO3

Molecular Mass

338.98

Cite this Page

Aeroplysinin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=28656-91-9 (retrieved 2024-11-24) (CAS RN: 28656-91-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H9Br2NO3/c1-15-7-5(10)4-9(14,2-3-12)8(13)6(7)11/h4,8,13-14H,2H2,1H3/t8-,9-/m0/s1

InChIKey

InChIKey=BGYNLOSBKBOJJD-IUCAKERBSA-N

SMILES

C(C#N)[C@@]1(O)[C@@H](O)C(Br)=C(OC)C(Br)=C1

Canonical SMILES

N#CCC1(O)C=C(Br)C(OC)=C(Br)C1O

Other Names for this Substance

  • 2,4-Cyclohexadiene-1-acetonitrile, 3,5-dibromo-1,6-dihydroxy-4-methoxy-, (1S,6R)-
  • 2,4-Cyclohexadiene-1-acetonitrile, 3,5-dibromo-1,6-dihydroxy-4-methoxy-, (1S-trans)-
  • (1S,6R)-3,5-Dibromo-1,6-dihydroxy-4-methoxy-2,4-cyclohexadiene-1-acetonitrile
  • Aeroplysinin I, (+)-
  • (+)-Aeroplysinin I

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Deleted or Replaced CAS Registry Numbers

34140-52-8

CAS INSIGHTSTM
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