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Substance Name: Of 4949-IV
RN: 107140-31-8
InChIKey: NCUQHNVGWPTBRI-JYJNAYRXSA-N

Note

  • Inhibitor of aminopeptidase B; produced by fungus Penicillium rugulosum OF4949.

Molecular Formula

  • C22-H24-N4-O7

Molecular Weight

  • 456.453
 
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Names and Synonyms

Name of Substance

  • Of 4949-IV

Synonyms

  • (9S-(9R*,12R*,15R*))-9-Amino-12-(2-amino-2-oxoethyl)-4-hydroxy-10,13-dioxo-2-oxa-11,14-diazatricyclo(15.2.2.1(3,7))docosa-3,5,7(22),17,19,20-hexaene-15-carboxylic acid
  • Of-4949IV

Systematic Name

  • 2-Oxa-11,14-diazatricyclo(15.2.2.1(3,7))docosa-3,5,7(22),17,19,20-hexaene-15-carboxylic acid, 9-amino-12-(2-amino-2-oxoethyl)-4-hydroxy-10,13-dioxo-, (9S-(9R*,12R*,15R*))-

Registry Numbers

CAS Registry Number

  • 107140-31-8

System Generated Number

  • 0107140318

Structure Descriptors

InChI

1S/C22H24N4O7/c23-14-7-12-3-6-17(27)18(9-12)33-13-4-1-11(2-5-13)8-16(22(31)32)26-21(30)15(10-19(24)28)25-20(14)29/h1-6,9,14-16,27H,7-8,10,23H2,(H2,24,28)(H,25,29)(H,26,30)(H,31,32)/t14-,15-,16-/m0/s1

InChIKey

NCUQHNVGWPTBRI-JYJNAYRXSA-N

Smiles

c12Oc3c(ccc(C[C@@H](C(N[C@H](C(N[C@@H](Cc(cc1)cc2)C(=O)O)=O)CC(=O)N)=O)N)c3)O