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Substance Name: YS 822A
RN: 130767-46-3
InChIKey: HCAJMOSNTHQEGE-HEVHWGFOSA-N

Note

  • Isolated from Streptoverticillum eurocidicum.

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C37-H59-N-O14

Molecular Weight

  • 741.866
 
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Names and Synonyms

Name of Substance

  • YS 822A

Synonym

  • YS-822A

Systematic Names

  • 10,29-Dioxabicyclo(23.3.1)nonacasa-15,17,19,21-tetraene-26-carboxylic acid, 23-((3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy)-1,3,5,6,27-pentahydroxy-11-(1-methylethyl)-9-oxo-
  • 10,29-Dioxabicyclo(23.3.1)nonacosa-15,17,19,21-tetraene-26-carboxylic acid, 23-((3-amino-3,6-dideoxy-beta-D-mannopyranosyl)oxy)-1,3,5,6,27-pentahydroxy-11-(1-methylethyl)-9-oxo-
  • Antibiotic YS 822A

Registry Numbers

CAS Registry Number

  • 130767-46-3

System Generated Number

  • 0130767463

Structure Descriptors

InChI

1S/C37H59NO14/c1-21(2)28-14-12-10-8-6-4-5-7-9-11-13-24(50-36-34(45)32(38)33(44)22(3)49-36)18-29-31(35(46)47)27(42)20-37(48,52-29)19-23(39)17-26(41)25(40)15-16-30(43)51-28/h4-9,11,13,21-29,31-34,36,39-42,44-45,48H,10,12,14-20,38H2,1-3H3,(H,46,47)/b5-4+,8-6-,9-7+,13-11+/t22-,23?,24?,25?,26?,27?,28?,29?,31?,32+,33-,34+,36+,37?/m1/s1

InChIKey

HCAJMOSNTHQEGE-HEVHWGFOSA-N

Smiles

C1[C@@]2(C[C@@H]([C@@H]([C@@H](C[C@@H](C=CC=CC=CC=CCCC[C@@H](OC(CC[C@@H]([C@@H](C[C@@H]1O)O)O)=O)C(C)C)O[C@H]1[C@@H](O)[C@H]([C@H](O)[C@H](O1)C)N)O2)C(=O)O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 120mg/kg (120mg/kg)   Journal of Antibiotics. Vol. 43, Pg. 948, 1990.