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Substance Name: 3-Fluoro-3-demethoxysporaricin A
RN: 83916-86-3
InChIKey: JMSOLLQJKDEKCD-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C16-H32-F-N5-O4

Molecular Weight

  • 377.4578
 
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Names and Synonyms

Results Name

  • 3-Fluoro-3-demethoxysporaricin A

Synonyms

  • 3-Fluoro-3-demethoxysporaricin A
  • Sporaricin A, 3-fluoro-3-demethoxy-

Systematic Name

  • D-allo-Inositol, 2-amino-5-((aminoacetyl)methylamino)-2,3,4,5-tetradeoxy-1-O-(2,6-diamino-2,3,4,6,7-pentadeoxy-beta-L-lyxo-heptopyranosyl)-4-fluoro-

Registry Numbers

CAS Registry Number

  • 83916-86-3

System Generated Number

  • 0083916863

Structure Descriptors

InChI

1S/C16H32FN5O4/c1-7(19)11-4-3-9(20)16(25-11)26-15-10(21)5-8(17)13(14(15)24)22(2)12(23)6-18/h7-11,13-16,24H,3-6,18-21H2,1-2H3

InChIKey

JMSOLLQJKDEKCD-UHFFFAOYSA-N

Smiles

CC(C1CCC(C(O1)OC2C(CC(C(C2O)N(C)C(=O)CN)F)N)N)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   Journal of Antibiotics. Vol. 35, Pg. 1245, 1982.