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Substance Name: 3,3-Difluoro-3-demethoxysporaricin A
RN: 83865-96-7
InChIKey: VSYXNSCGQZXYFD-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C16-H31-F2-N5-O4

Molecular Weight

  • 395.4479
 
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Names and Synonyms

Results Name

  • 3,3-Difluoro-3-demethoxysporaricin A

Synonyms

  • 3,3-Difluoro-3-demethoxysporaricin A
  • Sporaricin A, 3-demethoxy-3,3-difluoro-

Systematic Name

  • Acetamide, 2-amino-N-(4-amino-5-((2,6-diamino-2,3,4,6,7-pentadeoxy-beta-L-lyxo-heptopyranosyl)oxy)-2,2-difluoro-6-hydroxycyclohexyl)-N-methyl-, (1S-(1-alpha,4-beta,5-beta,6-alpha))-

Registry Numbers

CAS Registry Number

  • 83865-96-7

System Generated Number

  • 0083865967

Structure Descriptors

InChI

1S/C16H31F2N5O4/c1-7(20)10-4-3-8(21)15(26-10)27-13-9(22)5-16(17,18)14(12(13)25)23(2)11(24)6-19/h7-10,12-15,25H,3-6,19-22H2,1-2H3

InChIKey

VSYXNSCGQZXYFD-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous > 150mg/kg (150mg/kg)   Journal of Antibiotics. Vol. 35, Pg. 1245, 1982.