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Substance Name: Cyclobuxine D
RN: 2241-90-9
UNII: RP83EW60V2
InChIKey: BSNZFQANPMIOIU-WZBMPAQFSA-N

Note

  • Isolated from Buxus microphylla; protects heart from injuries resulting from ischemia and reperfusion.

Molecular Formula

  • C25-H42-N2-O

Molecular Weight

  • 386.6198
 

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product
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Names and Synonyms

Name of Substance

  • Cyclobuxine
  • Cyclobuxine D

Synonyms

  • Cyclobuxine
  • Cyclobuxine D
  • NSC 91720
  • NSC-102244
  • UNII-RP83EW60V2

Systematic Names

  • 9,19-Cyclo-5-alpha,9-beta-pregnan-16-alpha-ol, 14-methyl-3-beta,20-alpha-bis(methylamino)-4-methylene-
  • 9,19-Cyclo-5alpha,9beta-pregnan-16alpha-ol, 14-methyl-3beta,20alpha-bis(methylamino)-4-methylene- (8CI)
  • 9,19-Cyclopregnan-16-ol, 14-methyl-3,20-bis(methylamino)-4-methylene-, (3beta,5alpha,16alpha,20S)- (9CI)

Registry Numbers

CAS Registry Number

  • 2241-90-9

FDA UNII

  • RP83EW60V2

System Generated Number

  • 0002241909

Structure Descriptors

InChI

1S/C25H42N2O/c1-15-17-7-8-20-23(4)13-19(28)21(16(2)26-5)22(23,3)11-12-25(20)14-24(17,25)10-9-18(15)27-6/h16-21,26-28H,1,7-14H2,2-6H3/t16-,17-,18-,19+,20-,21-,22+,23-,24+,25-/m0/s1

InChIKey

BSNZFQANPMIOIU-WZBMPAQFSA-N

Smiles

CN[C@@H](C)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC[C@H]4C(=C)[C@H](CC[C@@]45C[C@@]35CC[C@]12C)NC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 300mg/kg (300mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 8(2), Pg. 217, 1982.