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Substance Name: Repromicin [USAN:INN]
RN: 56689-42-0
UNII: G5WU4SAO6B
InChIKey: OBUIQEYZGMZXPJ-NPQHDNJNSA-N

Note

  • See also record for antibiotics M-4365.

Classification Codes

  • Antibacterial
  • Antibiotics

Molecular Formula

  • C31-H51-N-O8

Molecular Weight

  • 565.7429
 
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Names and Synonyms

Name of Substance

  • De-epoxy rosamicin
  • Repromicin [USAN:INN]

Synonyms

  • 16-Ethyl-4-hydroxy-5,9,13,15-tetramethyl-2,10-dioxo-6-((3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyl)oxy)oxacyclohexadeca-11,13-diene-7-acetaldehyde
  • 16-Ethyl-4-hydroxy-5,9,13,15-tetramethyl-2,10-dioxo-6-(3,4,6-tridesoxy-3-dimethylamino-beta-D-xylo-hexopyranosyloxy)-1-oxa-11,13-cyclohexadecadien-7-yl)acetaldehyd
  • Repromicin
  • Repromicina
  • Repromicina [INN-Spanish]
  • Repromicine
  • Repromicine [INN-French]
  • Repromicinum
  • Repromicinum [INN-Latin]
  • Sch 16524
  • UNII-G5WU4SAO6B

Systematic Name

  • Cirramycin A1, 12,13-deepoxy-12,13-didehydro-4'-deoxy-

Registry Numbers

CAS Registry Number

  • 56689-42-0

FDA UNII

  • G5WU4SAO6B

System Generated Number

  • 0056689420

Structure Descriptors

InChI

1S/C31H51NO8/c1-9-27-20(4)14-18(2)10-11-25(34)19(3)15-23(12-13-33)30(22(6)26(35)17-28(36)39-27)40-31-29(37)24(32(7)8)16-21(5)38-31/h10-11,13-14,19-24,26-27,29-31,35,37H,9,12,15-17H2,1-8H3/b11-10+,18-14+/t19-,20+,21-,22+,23+,24+,26-,27-,29-,30-,31+/m1/s1

InChIKey

OBUIQEYZGMZXPJ-NPQHDNJNSA-N

Smiles

CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@H](CC=O)C[C@@H](C)C(=O)\C=C\C(=C\[C@@H]1C)\C

Physical Properties

Physical Property Value Units Temp (deg C) Source
pKa Dissociation Constant 8.83 (none) 25 EXP
log P (octanol-water) 2.49 (none)   EXP
Water Solubility 20.5 mg/L 25 EST
Vapor Pressure 9.04E-21 mm Hg 25 EST
Henry's Law Constant 1.84E-22 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.82E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.