Erythromycin A oxime

CAS Registry Number®

13127-18-9

CAS Name

Erythromycin A oxime

Molecular Formula

C37H68N2O13

Molecular Mass

748.94

Cite this Page

Erythromycin A oxime.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13127-18-9 (retrieved 2024-12-23) (CAS RN: 13127-18-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    184-189 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C37H68N2O13/c1-14-25-37(10,45)30(41)20(4)27(38-46)18(2)16-35(8,44)32(52-34-28(40)24(39(11)12)15-19(3)48-34)21(5)29(22(6)33(43)50-25)51-26-17-36(9,47-13)31(42)23(7)49-26/h18-26,28-32,34,40-42,44-46H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1

InChIKey

InChIKey=KYTWXIARANQMCA-RWJQBGPGSA-N

SMILES

O([C@H]1[C@H](C)[C@@H](O[C@H]2[C@H](O)[C@@H](N(C)C)C[C@@H](C)O2)[C@](C)(O)C[C@@H](C)C(=NO)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]1C)[C@H]3C[C@](OC)(C)[C@@H](O)[C@H](C)O3

Canonical SMILES

O=C1OC(CC)C(O)(C)C(O)C(C(=NO)C(C)CC(O)(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)C(OC3OC(C)C(O)C(OC)(C)C3)C1C)C

Other Names for this Substance

  • Erythromycin, 9-oxime
  • Oxacyclotetradecane, erythromycin deriv.
  • Erythromycin 9-ketoxime
  • Erythromycin A oxime
  • Erythromycin oxime

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Deleted or Replaced CAS Registry Numbers

16955-46-7

CAS INSIGHTSTM
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