chempirical

Nystatin

C47H75NO17CAS 1400-61-9926.11 g/mol

Open in Covalent MOL file
OOOHOHOHOHOOHOHOHOHOHOOOOHNH2OH
AcetalAlcoholAlkeneCarboxylic acidEsterEtherLactonePrimary amine

Properties

Molecular formula
C47H75NO17
Molar mass
926.11 g/mol
Exact mass
925.5035 Da
Melting point
44–46 °C
logP
0.94Crippen estimate
Polar surface area
319.6 Ų
H-bond donors / acceptors
12 / 17
Rotatable bonds
3
Stereocentres
S, S, S, R, R, S, S, S, S, Rin SMILES atom order
Double bonds
E, E, E, E, E, EE/Z, in SMILES order

Identifiers

CAS number
1400-61-9
SMILES
C[C@H]1/C=C/C=C/CC/C=C/C=C/C=C/C=C/C(CC2C(C(C[C@](O2)(CC(C(CCC(CC(CC(CC(=O)O[C@H]([C@@H]([C@@H]1O)C)C)O)O)O)O)O)O)O)C(=O)O)O[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)O)N)O
InChIKey
VQOXZBDYSJBXMA-RKEBNKJGSA-N
InChI
InChI=1S/C47H75NO17/c1-27-17-15-13-11-9-7-5-6-8-10-12-14-16-18-34(64-46-44(58)41(48)43(57)30(4)63-46)24-38-40(45(59)60)37(54)26-47(61,65-38)25-36(53)35(52)20-19-31(49)21-32(50)22-33(51)23-39(55)62-29(3)28(2)42(27)56/h5-6,8,10-18,27-38,40-44,46,49-54,56-58,61H,7,9,19-26,48H2,1-4H3,(H,59,60)/b6-5+,10-8+,13-11+,14-12+,17-15+,18-16+/t27-,28-,29-,30+,31?,32?,33?,34?,35?,36?,37?,38?,40?,41-,42+,43+,44-,46+,47+/m0/s1

Weigh it out

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

Names and synonyms

23 names · show all
  • Fungicidin
  • Mycostatin
  • Mykostatyna
  • Myconystatin
  • Stamycin
  • Candio-hermal
  • Diastatin
  • Nystan
  • Nystavescent
  • O-V Statin
  • Moronal (antibiotic)
  • Nistatin
  • Nysfungin
  • Nyotran
  • Nystop
  • L-Nystatin
  • Nystex
  • Biofanal
  • Mycostatin pastilles
  • Flagystatin
  • Nystacid
  • Ceratocide
  • Nilstat

Work with Nystatin

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

Similar compounds

Fungizone1397-89-389 % similar Natamycin7681-93-861 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook