chempirical

Erythromycin ethyl succinate

C43H75NO16CAS 1264-62-6862.06 g/mol

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AcetalAlcoholEsterEtherKetoneLactoneTertiary amine

Properties

Molecular formula
C43H75NO16
Molar mass
862.06 g/mol
Exact mass
861.5086 Da
Melting point
109–110 °C
logP
2.68Crippen estimate
Polar surface area
226.3 Ų
H-bond donors / acceptors
4 / 17
Rotatable bonds
12
Stereocentres
R, S, R, S, S, R, R, S, S, R, R, S, R, R, R, R, R, Sin SMILES atom order

Identifiers

CAS number
1264-62-6
SMILES
CCOC(=O)CCC(=O)O[C@H]1[C@H](O[C@@H]2[C@@H](C)[C@H](O[C@H]3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@]2(C)O)O[C@H](C)C[C@@H]1N(C)C
InChIKey
NSYZCCDSJNWWJL-YXOIYICCSA-N
InChI
InChI=1S/C43H75NO16/c1-15-29-43(11,52)36(48)24(5)33(47)22(3)20-41(9,51)38(25(6)34(26(7)39(50)57-29)59-32-21-42(10,53-14)37(49)27(8)56-32)60-40-35(28(44(12)13)19-23(4)55-40)58-31(46)18-17-30(45)54-16-2/h22-29,32,34-38,40,48-49,51-52H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,32+,34+,35-,36-,37+,38-,40+,41-,42-,43-/m1/s1

Weigh it out

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

Names and synonyms

25 names · show all
  • Erythromycin, 2′-(ethyl butanedioate)
  • Erythromycin, mono(ethyl succinate) (ester)
  • Erythromycin, 2′-(ethyl succinate)
  • Succinic acid, ethyl ester, monoester with erythromycin
  • Oxacyclotetradecane, erythromycin deriv.
  • Erythrocin ethyl succinate
  • Pediamycin
  • Erythroped
  • Evesin
  • Eritrocina
  • Esinol
  • EryPed
  • Paediathrocin
  • Erythro ES
  • Wyamycin E
  • Sigapedil
  • Durapaediat
  • Eryliquid
  • EES
  • Arpimycin
  • Erythro-holz
  • Refkas
  • Anamycin
  • E-Mycin e
  • Monomycin

Work with Erythromycin ethyl succinate

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

Erythromycin114-07-880 % similar Erythromycin estolate3521-62-875 % similar Clarithromycin81103-11-974 % similar Erythromycin thiocyanate7704-67-874 % similar Erythromycin stearate643-22-173 % similar Erythromycin A oxime13127-18-969 % similar Erythromycin A 11,12-carbonate55224-05-066 % similar Erythromycin lactobionate3847-29-865 % similar

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

Elsewhere

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