Mirosamicin

CAS Registry Number®

73684-69-2
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CAS Name

Mirosamicin

Molecular Formula

C37H61NO13

Molecular Mass

727.88

Cite this Page

Mirosamicin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=73684-69-2 (retrieved 2024-05-06) (CAS RN: 73684-69-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C37H61NO13/c1-11-27-37(43,18-46-36-33(45-10)32(44-9)29(41)23(6)48-36)34-26(49-34)14-13-25(39)20(3)16-21(4)31(19(2)12-15-28(40)50-27)51-35-30(42)24(38(7)8)17-22(5)47-35/h12-15,19-24,26-27,29-36,41-43H,11,16-18H2,1-10H3/b14-13-,15-12+/t19-,20+,21-,22+,23+,24-,26-,27+,29+,30+,31+,32+,33+,34+,35-,36+,37-/m0/s1

InChIKey

InChIKey=WWIDEZOUVSJVHS-QWIQBYSJSA-N

SMILES

C(O[C@H]1[C@H](OC)[C@H](OC)[C@H](O)[C@@H](C)O1)[C@@]2(O)[C@]3([C@@](O3)(/C=C\C(=O)[C@H](C)C[C@H](C)[C@H](O[C@H]4[C@H](O)[C@@H](N(C)C)C[C@@H](C)O4)[C@@H](C)\C=C\C(=O)O[C@@H]2CC)[H])[H]

Canonical SMILES

O=C1OC(CC)C(O)(COC2OC(C)C(O)C(OC)C2OC)C3OC3C=CC(=O)C(C)CC(C)C(OC4OC(C)CC(N(C)C)C4O)C(C=C1)C

Other Names for this Substance

  • 4,17-Dioxabicyclo[14.1.0]heptadeca-6,14-diene-5,13-dione, 2-[[(6-deoxy-2,3-di-O-methyl-β-D-allopyranosyl)oxy]methyl]-3-ethyl-2-hydroxy-8,10,12-trimethyl-9-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]-, (1R,2S,3R,6E,8S,9S,10S,12R,14E,16S)-
  • Mycinamicin I, 14-hydroxy-
  • 4,17-Dioxabicyclo[14.1.0]heptadecane, mycinamicin I deriv.
  • (1R,2S,3R,6E,8S,9S,10S,12R,14E,16S)-2-[[(6-Deoxy-2,3-di-O-methyl-β-D-allopyranosyl)oxy]methyl]-3-ethyl-2-hydroxy-8,10,12-trimethyl-9-[[3,4,6-trideoxy-3-(dimethylamino)-β-D-xylo-hexopyranosyl]oxy]-4,17-dioxabicyclo[14.1.0]heptadeca-6,14-diene-5,13-dione
  • Mycinamicin II

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Deleted or Replaced CAS Registry Numbers

73905-37-0

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