Cas no 3482-49-3 (Lumifusidic Acid)

Lumifusidic Acid structure
Lumifusidic Acid structure
Product Name:Lumifusidic Acid
CAS No:3482-49-3
MF:C31H48O6
MW:516.709230422974
CID:2004551
PubChem ID:5280986
Update Time:2025-04-21

Lumifusidic Acid Chemical and Physical Properties

Names and Identifiers

    • Fusicsaeure
    • fusidic acid
    • CHEMBL1334456
    • SCHEMBL6687912
    • Lumifusidic Acid
    • 29-Nordammara-17(20),24-dien-21-oic acid,16-(acetyloxy)-3,11-dihydroxy-, (3a,4a,8a,9b,11a,13a,14b,16b,17E)-
    • (3?,?4?,?8?,?9?,?11?,?13?,?14?,?16?,?17E)?-16-?(Acetyloxy)?-?3,?11-?dihydroxy-?29-?Nordammara-?17(20)?,?24-?dien-?21-?oic Acid
    • 3482-49-3
    • Inchi: 1S/C31H48O6/c1-17(2)9-8-10-20(28(35)36)26-22-15-24(34)27-29(5)13-12-23(33)18(3)21(29)11-14-30(27,6)31(22,7)16-25(26)37-19(4)32/h9,18,21-25,27,33-34H,8,10-16H2,1-7H3,(H,35,36)/b26-20+/t18-,21-,22-,23+,24+,25-,27-,29-,30-,31-/m0/s1
    • InChI Key: IECPWNUMDGFDKC-UEVMROTKSA-N
    • SMILES: O[C@@H]1C[C@H]2/C(=C(\C(=O)O)/CC/C=C(\C)/C)/[C@H](C[C@]2(C)[C@@]2(C)CC[C@H]3[C@H](C)[C@@H](CC[C@]3(C)[C@@H]21)O)OC(C)=O

Computed Properties

  • Exact Mass: 516.34508925Da
  • Monoisotopic Mass: 516.34508925Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 37
  • Rotatable Bond Count: 6
  • Complexity: 994
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 10
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 5.5
  • Topological Polar Surface Area: 104?2

Lumifusidic Acid Pricemore >>

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