Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Neopluramycin
RN: 11081-47-3
InChIKey: IGGBURDWCSROFD-PDGQHHTCSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C41-H50-N2-O10

Molecular Weight

  • 730.85
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • Neopluramycin

Synonyms

  • BRN 1676377
  • Neopluramycin

Systematic Name

  • 4H-Anthra(1,2-b)pyran-4,7,12-trione, 10-(4-O-acetyl-2,3,6-trideoxy-3-(dimethylamino)-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-11-hydroxy-5-methyl-2-(1-methyl-1-propenyl)-8-(2,3,6-trideoxy-3-(dimethylamino)-beta-D-arabino-hexopyranosyl)-, (E)-

Registry Numbers

CAS Registry Number

  • 11081-47-3

System Generated Number

  • 0011081473

Structure Descriptors

InChI

1S/C41H50N2O10/c1-12-18(2)29-16-28(45)31-19(3)13-25-33(39(31)53-29)38(49)34-32(37(25)48)24(30-15-27(42(8)9)35(46)20(4)51-30)14-23(36(34)47)26-17-50-21(5)40(52-22(6)44)41(26,7)43(10)11/h12-14,16,20-21,26-27,30,35,40,46-47H,15,17H2,1-11H3/b18-12-

InChIKey

IGGBURDWCSROFD-PDGQHHTCSA-N

Smiles

O([C@@H]1[C@@H](OC[C@@H]([C@@]1(N(C)C)C)c1c(c2c(C(c3c(C2=O)c2c(c(cc(o2)C(=C\C)\C)=O)c(c3)C)=O)c([C@@H]2C[C@@H](N(C)C)[C@@H](O)[C@@H](O2)C)c1)O)C)C(=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 12500ug/kg (12.5mg/kg)   Journal of Antibiotics. Vol. 23, Pg. 354, 1970.