Erythromycin E

CAS Registry Number®

41451-91-6
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CAS Name

Erythromycin E

Molecular Formula

C37H65NO14

Molecular Mass

747.91

Cite this Page

Erythromycin E.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=41451-91-6 (retrieved 2024-05-03) (CAS RN: 41451-91-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H65NO14/c1-13-25-36(9,45)29(41)20(4)26(39)18(2)15-34(7,44)31(50-33-27(40)24(38(10)11)14-19(3)48-33)21(5)28-23(32(43)49-25)16-47-37(52-28)17-35(8,46-12)30(42)22(6)51-37/h18-25,27-31,33,40-42,44-45H,13-17H2,1-12H3/t18-,19-,20+,21+,22+,23-,24+,25-,27-,28+,29-,30+,31-,33+,34-,35-,36-,37-/m1/s1

InChIKey

InChIKey=PRUSTPADOGZAML-LMXGZOGMSA-N

SMILES

O(C)[C@]1(C)C[C@]2(O[C@@]3([C@@](CO2)(C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@](C)(O)[C@H](O[C@H]4[C@H](O)[C@@H](N(C)C)C[C@@H](C)O4)[C@H]3C)[H])[H])O[C@@H](C)[C@@H]1O

Canonical SMILES

O=C1OC(CC)C(O)(C)C(O)C(C(=O)C(C)CC(O)(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)C3OC4(OCC13)OC(C)C(O)C(OC)(C)C4)C

Other Names for this Substance

  • Erythromycin, 1′′,16-epoxy-
  • Spiro[5H,11H-1,3-dioxino[5,4-c]oxacyclotetradecin-2,2′-[2H]pyran], erythromycin deriv.
  • Erythromycin E

Deleted or Replaced CAS Registry Numbers

42209-16-5

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