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Substance Name: Napyradiomycin B3
RN: 103106-22-5
UNII: VA34YQT845
InChIKey: UTARAOYMLWGJAB-BFUNRSHFSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C25-H29-Br-Cl2-O5

Molecular Weight

  • 562.2813
 
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Names and Synonyms

Results Name

  • Napyradiomycin B3

Name of Substance

  • Napyradiomycin B3

Synonyms

  • Antibiotic MG 802AFB3
  • MG 802AF2B3
  • Napyradiomycin B3
  • UNII-VA34YQT845

Systematic Name

  • 2H-Naphtho(2,3-b)pyran-5,10-dione, 3,4,4a,10a-tetrahydro-10a-((3-bromo-2,2-dimethyl-6-methylenecyclohexyl)methyl)-6,8-hydroxy-2,2-dimethyl-

Registry Numbers

CAS Registry Number

  • 103106-22-5

FDA UNII

  • VA34YQT845

System Generated Number

  • 0103106225

Structure Descriptors

InChI

1S/C24H27BrCl2O6/c1-11-6-7-15(25)21(2,3)20(11)32-24-18(30)13-8-12(28)9-14(29)17(13)19(31)23(24,27)10-16(26)22(4,5)33-24/h8-9,15-16,20,28-29H,1,6-7,10H2,2-5H3/t15-,16+,20+,23-,24-/m0/s1

InChIKey

UTARAOYMLWGJAB-BFUNRSHFSA-N

Smiles

CC1(C)O[C@@]2(O[C@@H]3C(=C)CC[C@H](Br)C3(C)C)C(=O)c4cc(O)cc(O)c4C(=O)[C@@]2(Cl)C[C@H]1Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 125mg/kg (125mg/kg)   Journal of Antibiotics. Vol. 39, Pg. 487, 1986.