Cas no 80451-74-7 (3',4'-dideoxyparomomycin)

3',4'-dideoxyparomomycin structure
3',4'-dideoxyparomomycin structure
Product Name:3',4'-dideoxyparomomycin
CAS No:80451-74-7
MF:C23H45N5O12
MW:583.629707098007
CID:985660
PubChem ID:196166
Update Time:2025-04-20

3',4'-dideoxyparomomycin Chemical and Physical Properties

Names and Identifiers

    • 3',4'-dideoxyparomomycin
    • 80451-74-7
    • DTXSID501001248
    • D-Streptamine, O-2-amino-2,3,4-trideoxy-alpha-D-erythro-hexopyranosyl-(1-4)-O-(O-2,6-diamino-2,6-dideoxy-beta-L-idopyranosyl-(1-3)-beta-D-ribofuranosyl-(1-5))-2-deoxy-
    • 4,6-Diamino-2-{[3-O-(2,6-diamino-2,6-dideoxyhexopyranosyl)pentofuranosyl]oxy}-3-hydroxycyclohexyl 2-amino-2,3,4-trideoxyhexopyranoside
    • 5-amino-2-(aminomethyl)-6-[5-[3,5-diamino-2-[3-amino-6-(hydroxymethyl)oxan-2-yl]oxy-6-hydroxycyclohexyl]oxy-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxyoxane-3,4-diol
    • Inchi： 1S/C23H45N5O12/c24-4-11-15(32)16(33)13(28)22(36-11)39-19-12(6-30)37-23(17(19)34)40-20-14(31)9(26)3-10(27)18(20)38-21-8(25)2-1-7(5-29)35-21/h7-23,29-34H,1-6,24-28H2
    • InChI Key： KEWBPXDTCLTDNZ-UHFFFAOYSA-N
    • SMILES： O(C1C(C(C(CO)O1)OC1C(C(C(C(CN)O1)O)O)N)O)C1C(C(CC(C1OC1C(CCC(CO)O1)N)N)N)O

Computed Properties

  • Exact Mass: 583.306
  • Monoisotopic Mass: 583.306
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 11
  • Hydrogen Bond Acceptor Count: 17
  • Heavy Atom Count: 40
  • Rotatable Bond Count: 9
  • Complexity: 807
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 17
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -7.3
  • Topological Polar Surface Area: 307?2

Experimental Properties

  • Density: 1.54
  • Boiling Point: 867.6°C at 760 mmHg
  • Flash Point: 478.5°C
  • Refractive Index: 1.648

3',4'-dideoxyparomomycin Related Literature

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