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Substance Name: Napyradiomycin A1
RN: 103106-24-7
InChIKey: BCPWMPCOEAOEDD-NQSCOFRMSA-N

Note

  • From culture broth Chainia rubra MG802-AF1.

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C25-H30-Cl2-O5

Molecular Weight

  • 481.413
 
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Names and Synonyms

Name of Substance

  • Napyradiomycin A1

Synonyms

  • Napyradiomycin A
  • Napyradiomycin A1

Systematic Names

  • 2H-Naphtho(2,3-b)pyran-5,10-dione, 3,4,4a,10a-tetrahydro-3,4a-dichloro-10a-(3,7-dimethyl-2,6-octadienyl)-6,8-dihydroxy-2,2-dimethyl-
  • 2H-Naphtho(2,3-b)pyran-5,10-dione, 3,4a-dichloro-10a-(3,7-dimethyl-2,6-octadienyl)-3,4,4a,10a-tetrahydro-6,8-dihydroxy-2,2-dimethyl-

Registry Numbers

CAS Registry Number

  • 103106-24-7

System Generated Number

  • 0103106247

Structure Descriptors

InChI

1S/C25H30Cl2O5/c1-14(2)7-6-8-15(3)9-10-25-21(30)17-11-16(28)12-18(29)20(17)22(31)24(25,27)13-19(26)23(4,5)32-25/h7,9,11-12,19,28-29H,6,8,10,13H2,1-5H3/b15-9+/t19-,24+,25+/m1/s1

InChIKey

BCPWMPCOEAOEDD-NQSCOFRMSA-N

Smiles

CC(=CCC\C(=C\C[C@@]12OC(C)(C)[C@H](Cl)C[C@]1(Cl)C(=O)c3c(O)cc(O)cc3C2=O)\C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 250mg/kg (250mg/kg)   Journal of Antibiotics. Vol. 39, Pg. 487, 1986.