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Substance Name: Bequinostatin A
RN: 151013-37-5
InChIKey: RKXRXHADKSOULC-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C28-H24-O9

Molecular Weight

  • 504.489
 
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Names and Synonyms

Name of Substance

  • Bequinostatin A

Synonym

  • Bequinostatin A

Systematic Name

  • Benzo(a)naphthacene-2-carboxylic acid, 5,6,8,13-tetrahydro-8,13-dioxo-1,6,7,9,11-pentahydroxy-3-pentyl-, (-)-

Registry Numbers

CAS Registry Number

  • 151013-37-5

System Generated Number

  • 0151013375

Structure Descriptors

InChI

1S/C28H24O9/c1-2-3-4-5-11-6-12-7-17(30)21-14(19(12)25(33)20(11)28(36)37)10-16-23(26(21)34)27(35)22-15(24(16)32)8-13(29)9-18(22)31/h6,8-10,17,29-31,33-34H,2-5,7H2,1H3,(H,36,37)

InChIKey

RKXRXHADKSOULC-UHFFFAOYSA-N

Smiles

c12c(C[C@@H](c3c(c4C(c5c(cc(cc5C(c4cc13)=O)O)O)=O)O)O)cc(c(c2O)C(=O)O)CCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 100mg/kg (100mg/kg)   Journal of Antibiotics. Vol. 46, Pg. 914, 1993.