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Substance Name: Eremomycin aglycone hexapeptide
RN: 185461-61-4
InChIKey: ZUXYELXLKGTWOK-WZRYFPGASA-N

Molecular Formula

  • C46-H40-Cl-N7-O16

Molecular Weight

  • 982.308
 
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Names and Synonyms

Results Name

  • Eremomycin aglycone hexapeptide

Synonyms

  • Des-(N-methyl-D-leucyl)eremomycin aglycon
  • EAH 964
  • Eremomycin aglycone hexapeptide

Systematic Name

  • Vancomycin, 44-O-de(2-O-(3-amino-2,3,6-trideoxy-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-beta-D-glucopyranosyl)-19-dechloro-49-de(4-methyl-2-(methylamino)-1-oxopentyl)-

Registry Numbers

CAS Registry Number

  • 185461-61-4

System Generated Number

  • 0185461614

Structure Descriptors

InChI

1S/C46H40ClN7O16/c47-24-10-18-4-8-28(24)70-30-12-19-11-29(40(30)61)69-21-5-1-16(2-6-21)39(60)37-45(66)53-36(46(67)68)23-13-20(55)14-27(57)32(23)22-9-17(3-7-26(22)56)34(43(64)54-37)52-44(65)35(19)51-41(62)25(15-31(48)58)50-42(63)33(49)38(18)59/h1-14,25,33-39,55-57,59-61H,15,49H2,(H2,48,58)(H,50,63)(H,51,62)(H,52,65)(H,53,66)(H,54,64)(H,67,68)/t25-,33+,34+,35+,36-,37-,38+,39+/m0/s1

InChIKey

ZUXYELXLKGTWOK-WZRYFPGASA-N

Smiles

c1cc2ccc1[C@H]([C@H]3C(=O)N[C@@H](c4cc(cc(c4-c5cc(ccc5O)[C@H](C(=O)N3)NC(=O)[C@H]6c7cc(c(c(c7)Oc8ccc(cc8Cl)[C@H]([C@H](C(=O)N[C@H](C(=O)N6)CC(=O)N)N)O)O)O2)O)O)C(=O)O)O