Cas no 66065-96-1 (Antibiotic Su-1)

Antibiotic Su-1 structure
Antibiotic Su-1 structure
Product Name:Antibiotic Su-1
CAS No:66065-96-1
MF:C19H38N4O8
MW:450.527025699615
CID:963113
PubChem ID:194221
Update Time:2024-03-01

Antibiotic Su-1 Chemical and Physical Properties

Names and Identifiers

    • Su-2 complex
    • Antibiotic Su-1
    • Su-1 Antibiotic
    • Antibiotic Su-2
    • Su-3 Antibiotic
    • Su-2 Antibiotic
    • Antibiotic Su-3
    • 6-amino-3-{[3-deoxy-4-c-methyl-3-(methylamino)pentopyranosyl]oxy}-2,4-dihydroxycyclohexyl 2,6-diamino-2,3,4,6-tetradeoxyhexopyranoside
    • D-myo-Inositol, O-3-deoxy-4-C-methyl-3-(methylamino)-beta-L-arabinopyranosyl-(1-6)-O-(2,6-diamino-2,3,4,6-tetradeoxy-alpha-D-erythro-hexopyranosyl-(1-4))-3-amino-2,3-dideoxy-
    • 2-[4-amino-3-[3-amino-6-(aminomethyl)oxan-2-yl]oxy-2,6-dihydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol
    • SU-2
    • 66065-96-1
    • CHEBI:223318
    • DTXSID30984561
    • Inchi: 1S/C19H38N4O8/c1-19(27)7-28-18(13(26)16(19)23-2)31-15-11(24)5-10(22)14(12(15)25)30-17-9(21)4-3-8(6-20)29-17/h8-18,23-27H,3-7,20-22H2,1-2H3
    • InChI Key: HWDOCDZRMDHDSC-UHFFFAOYSA-N
    • SMILES: O(C1C(C(C(C)(CO1)O)NC)O)C1C(CC(C(C1O)OC1C(CCC(CN)O1)N)N)O

Computed Properties

  • Exact Mass: 450.269
  • Monoisotopic Mass: 450.269
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 8
  • Hydrogen Bond Acceptor Count: 12
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 6
  • Complexity: 591
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 12
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 208
  • XLogP3: -4.8

Experimental Properties

  • Density: 1.39
  • Boiling Point: 691.3°C at 760 mmHg
  • Flash Point: 371.9°C
  • Refractive Index: 1.603
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