Lucensomycin

CAS Registry Number®

13058-67-8
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CAS Name

Lucensomycin

Molecular Formula

C36H53NO13

Molecular Mass

707.80

Cite this Page

Lucensomycin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=13058-67-8 (retrieved 2024-04-25) (CAS RN: 13058-67-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H53NO13/c1-3-4-12-23-13-10-8-6-5-7-9-11-14-24(48-35-33(42)31(37)32(41)21(2)46-35)18-28-30(34(43)44)25(39)20-36(45,50-28)19-22(38)17-27-26(49-27)15-16-29(40)47-23/h5-11,14-16,21-28,30-33,35,38-39,41-42,45H,3-4,12-13,17-20,37H2,1-2H3,(H,43,44)/b6-5+,9-7-,10-8+,14-11+,16-15+/t21-,22+,23?,24+,25+,26-,27-,28+,30-,31+,32-,33+,35+,36-/m1/s1

InChIKey

InChIKey=MUAOHYJGHYFDSA-OTAPSQDXSA-N

SMILES

C(O)(=O)[C@H]1[C@]2(O[C@@](O)(C[C@@H]1O)C[C@@H](O)C[C@@]3([C@](O3)(/C=C/C(=O)OC(CCCC)C/C=C/C=C/C=C\C=C\[C@H](O[C@H]4[C@@H](O)[C@@H](N)[C@H](O)[C@@H](C)O4)C2)[H])[H])[H]

Canonical SMILES

O=C(O)C1C(O)CC2(O)OC1CC(OC3OC(C)C(O)C(N)C3O)C=CC=CC=CC=CCC(OC(=O)C=CC4OC4CC(O)C2)CCCC

Other Names for this Substance

  • 6,11,28-Trioxatricyclo[22.3.1.05,7]octacosa-8,14,16,18,20-pentaene-25-carboxylic acid, 22-[(3-amino-3,6-dideoxy-β-D-mannopyranosyl)oxy]-12-butyl-1,3,26-trihydroxy-10-oxo-
  • Lucensomycin
  • Etruscomycin
  • 6,11,28-Trioxatricyclo[22.3.1.05,7]octacosane, lucensomycin deriv.
  • (1R,3S,5R,7R,8E,14E,16E,18E,20E,22R,24S,25R,26S)-22-[(3-Amino-3,6-dideoxy-β-D-mannopyranosyl)oxy]-12-butyl-1,3,26-trihydroxy-10-oxo-6,11,28-trioxatricyclo[22.3.1.05,7]octacosa-8,14,16,18,20-pentaene-25-carboxylic acid

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Deleted or Replaced CAS Registry Numbers

4009-47-6, 11013-29-9, 11035-14-6, 24032-56-2, 51273-85-9, 1384655-66-6

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