Epithienamycin F

CAS Registry Number®

79057-45-7

CAS Name

Epithienamycin F

Molecular Formula

C13H18N2O8S2

Molecular Mass

394.42

Cite this Page

Epithienamycin F.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=79057-45-7 (retrieved 2024-11-22) (CAS RN: 79057-45-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H18N2O8S2/c1-6(23-25(20,21)22)10-8-5-9(24-4-3-14-7(2)16)11(13(18)19)15(8)12(10)17/h6,8,10H,3-5H2,1-2H3,(H,14,16)(H,18,19)(H,20,21,22)/t6-,8+,10-/m0/s1

InChIKey

InChIKey=HZYSJDYRQDXUAB-IONOHQLYSA-N

SMILES

[C@H](OS(=O)(=O)O)(C)[C@]1([C@@]2(N(C(C(O)=O)=C(SCCNC(C)=O)C2)C1=O)[H])[H]

Canonical SMILES

O=C(O)C1=C(SCCNC(=O)C)CC2N1C(=O)C2C(OS(=O)(=O)O)C

Other Names for this Substance

  • 1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-[[2-(acetylamino)ethyl]thio]-7-oxo-6-[(1S)-1-(sulfooxy)ethyl]-, (5R,6R)-
  • 1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-[[2-(acetylamino)ethyl]thio]-7-oxo-6-[1-(sulfooxy)ethyl]-, [5R-[5α,6β(S*)]]-
  • (5R,6R)-3-[[2-(Acetylamino)ethyl]thio]-7-oxo-6-[(1S)-1-(sulfooxy)ethyl]-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
  • Epithienamycin F

Deleted or Replaced CAS Registry Numbers

78971-69-4

CAS INSIGHTSTM
Targeted protein degrader structure, illustration