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Substance Name: Erythromycin fumarate
RN: 144331-28-2
InChIKey: AFWGHSXNGWVDRI-STEFZQRDSA-N

Molecular Formula

  • C37-H67-N-O13.C4-H4-O4

Molecular Weight

  • 850.0019
 
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Names and Synonyms

Results Name

  • Erythromycin fumarate

Synonyms

  • Erythromycin fumarate
  • Oxacyclotetradecane, erythromycin deriv.

Systematic Names

  • Erythromycin, (2E)-2-butenedioate (1:1) (salt)
  • Erythromycin, (E)-2-butenedioate (1:1) (salt)

Registry Numbers

CAS Registry Number

  • 144331-28-2

System Generated Number

  • 0144331282

Molecular Formulas

Molecular Formula

  • C37-H67-N-O13.C4-H4-O4

Molecular Formula Fragments

  • C37-H67-N-O13
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C37H67NO13.C4H4O4/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26;5-3(6)1-2-4(7)8/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-;/m1./s1

InChIKey

AFWGHSXNGWVDRI-STEFZQRDSA-N

Smiles

CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O.C(=C/C(=O)O)\C(=O)O