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Home> Hot Product Listed R   > Ramoplanin A 1 (peptidemoiety), 11-[(2S)-2-[4-(a-D-mannopyranosyloxy)phenyl]glycine]- (9CI)
132546-81-7 structure

Ramoplanin A 1 (peptidemoiety), 11-[(2S)-2-[4-(a-D-mannopyranosyloxy)phenyl]glycine]- (9CI)

Iupac Name:methyl 6-morpholin-4-ylpyridine-3-carboxylate
CAS No.:132546-81-7
Molecular Weight:222.244
Molecular Formula:C38H47NO12 (isomer)
Names and Identifiers
Synonyms

1-Oxa-4,7,10,13,16,19,22,25,28,31,34,37,40,43,46-pentadecaazacyclononatetracontane,cyclic peptide deriv. Antibiotic A 16686A'1 RamoplaninA' 1

Inchi
InChI=1S/C11H14N2O3/c1-15-11(14)9-2-3-10(12-8-9)13-4-6-16-7-5-13/h2-3,8H,4-7H2,1H3
InChkey
FFBPRHFKXVNLDV-UHFFFAOYSA-N
Canonical Smiles
COC(=O)C1=CN=C(C=C1)N2CCOCC2
Properties
Density
1.45
Melting Point
113 °C
Boiling Point
1042.769°C at 760 mmHg
Vapour
4.36E-06mmHg at 25°C
Refractive Index
1.542
Safety and Handling
Risk Statements
R36/37/38
Safety Statements
S26;S37/39
Computational chemical data
  • Molecular Weight:222.244g/mol
  • Molecular Formula:C38H47NO12
  • Compound Is Canonicalized:True
  • Exact Mass:222.1
  • Monoisotopic Mass:222.1
  • Complexity:241
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:51.7A^2
  • Heavy Atom Count:16
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccBzMAAAAAAAAAAAAAAAAAAAAAAAAAAsWAAAAAAAAAABgAAAHgAAAAAADADhmgY/uJMIFACo AjL3bACCgCk1AiAJ2CE4bNiKJvrAvZmHMYhuwAPY6eaYEQIMAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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