β-Apooxytetracycline

CAS Registry Number®

18751-99-0

CAS Name

β-Apooxytetracycline

Molecular Formula

C22H22N2O8

Molecular Mass

442.42

Cite this Page

β-Apooxytetracycline.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1361013-49-1 (retrieved 2024-11-22) (CAS RN: 18751-99-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H22N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)20(32-22(12)31)13-15(24(2)3)17(27)14(21(23)30)19(29)18(13)28/h4-6,13,15,18,20,25-28H,1-3H3,(H2,23,30)/t13-,15-,18+,20-/m0/s1

InChIKey

InChIKey=DRKMHDAKULCOKQ-VPZFNDQJSA-N

SMILES

CC1=C2[C@](OC(=O)C2=C(O)C=3C1=CC=CC3O)([C@]4([C@H](N(C)C)C(O)=C(C(N)=O)C(=O)[C@@H]4O)[H])[H]

Canonical SMILES

O=C1OC(C2=C1C(O)=C3C(O)=CC=CC3=C2C)C4C(O)C(=O)C(C(=O)N)=C(O)C4N(C)C

Other Names for this Substance

  • 1-Cyclohexene-1-carboxamide, 4-[(3R)-1,3-dihydro-4,5-dihydroxy-9-methyl-3-oxonaphtho[2,3-c]furan-1-yl]-3-(dimethylamino)-2,5-dihydroxy-6-oxo-, (3S,4S,5R)-
  • (3S,4S,5R)-4-[(1R)-1,3-Dihydro-4,5-dihydroxy-9-methyl-3-oxonaphtho[2,3-c]furan-1-yl]-3-(dimethylamino)-2,5-dihydroxy-6-oxo-1-cyclohexene-1-carboxamide
  • β-Apooxytetracycline
  • β-Apoterramycin
  • β-Apo-5-oxytetracycline

Deleted or Replaced CAS Registry Numbers

1361013-49-1

CAS INSIGHTSTM
Targeted protein degrader structure, illustration