chempirical

Fusidic acid

C31H48O6CAS 6990-06-3516.72 g/mol

Open in Covalent MOL file
OOOHHOOHO
AlcoholAlkeneCarboxylic acidEster

Properties

Molecular formula
C31H48O6
Molar mass
516.72 g/mol
Exact mass
516.3451 Da
Melting point
192.5 °C
logP
5.67Crippen estimate
Polar surface area
104.1 Ų
H-bond donors / acceptors
3 / 5
Rotatable bonds
5
Stereocentres
S, S, R, R, S, S, R, S, S, Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
6990-06-3
SMILES
CC(=O)O[C@H]1C[C@@]2(C)[C@@H](C[C@@H](O)[C@H]3[C@@]4(C)CC[C@@H](O)[C@@H](C)[C@@H]4CC[C@@]32C)/C1=C(CCC=C(C)C)C(=O)O
InChIKey
IECPWNUMDGFDKC-MZJAQBGESA-N
InChI
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

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

14 names · show all
  • 29-Nordammara-17(20),24-dien-21-oic acid, 16-(acetyloxy)-3,11-dihydroxy-, (3α,4α,8α,9β,11α,13α,14β,16β,17Z)-
  • 29-Nor-8α,9β,13α,14β-dammara-17(20),24-dien-21-oic acid, 3α,11α,16β-trihydroxy-, 16-acetate, (Z)-
  • (3α,4α,8α,9β,11α,13α,14β,16β,17Z)-16-(Acetyloxy)-3,11-dihydroxy-29-nordammara-17(20),24-dien-21-oic acid
  • Ramycin
  • SQ 16603
  • Fucithalmic
  • Fusidinic acid
  • NSC 56192
  • Flucidin
  • Foban
  • Fugen
  • Optifucin
  • Phudicin
  • Usidin

Work with Fusidic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Sodium fusidate751-94-0Salt

Similar compounds

Ecdysone3604-87-334 % similar Protopanaxatriol1453-93-632 % similar Protopanaxatriol34080-08-532 % similar (20S)-Protopanaxadiol30636-90-932 % similar Ginsenoside rk3364779-15-731 % similar Ginsenoside F153963-43-231 % similar Ginsenoside rh163223-86-931 % similar Ginsenoside 20(R)-rh180952-71-231 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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