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Substance Name: EM 5519
RN: 87578-99-2
InChIKey: GKUZBRIJGIGFKC-XPXFATIHSA-N

Note

  • From Pseudomonas fluorescens.

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C28-H36-N4-O7

Molecular Weight

  • 540.613
 
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Names and Synonyms

Name of Substance

  • EM 5519
  • Safracin B

Synonyms

  • Antibiotic EM 5519
  • Antibiotic Y 16482-alpha
  • Safracin B

Systematic Names

  • Antibiotic Y 16482alpha
  • Propanamide, 2-amino-N-((6,7,9,10,13,14,14a,15-octahydro-1,7-dihydroxy-2,11-dimethoxy-3,12,16-trimethyl-10,13-dioxo-6,15-imino-5H-isoquino(3,2-b)(3)benzazocin-9-yl)methyl)-

Registry Numbers

CAS Registry Number

  • 87578-99-2

Other Registry Number

  • 82029-27-4

System Generated Number

  • 0087578992

Structure Descriptors

InChI

1S/C28H36N4O7/c1-11-7-14-8-17-28(37)32-16(21(31(17)4)19(14)23(34)25(11)38-5)9-15-20(18(32)10-30-27(36)13(3)29)24(35)26(39-6)12(2)22(15)33/h7,13,16-18,21,28,34,37H,8-10,29H2,1-6H3,(H,30,36)/t13-,16-,17+,18-,21+,28-/m0/s1

InChIKey

GKUZBRIJGIGFKC-XPXFATIHSA-N

Smiles

c1(O)c(c(C)cc2c1[C@H]1[N@@]([C@H]([C@@H]([N@@]3[C@@H](CNC([C@H](C)N)=O)C=4C(=O)C(=C(C)C(C4C[C@@H]13)=O)OC)O)C2)C)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 3540ug/kg (3.54mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #83-113192,