Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Kirrothricin
RN: 79190-00-4
InChIKey: GFPYWBPGDHFJDP-PWXLXMISSA-N

Molecular Formula

  • C44-H64-N2-O10

Molecular Weight

  • 780.9936
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Kirrothricin

Systematic Names

  • 2H-Pyran-2-acetamide, N-((2E,4E,6S,7S,9S,10E,12E,14E,16E)-8,9-dihydroxy-6-methoxy-5,7,17-trimethyl-18-oxo-18-(1,2,5,6-tetrahydro-4-hydroxy-1-methyl-2-oxo-3-pyridinyl)-2,4-dihydroxy-5,5-dimethyl-6-((1E,3Z)-1,3-pentadienyl)-, (alphaS,2S,4S,6S)-
  • Mocimycin, 14,17-deepoxy-14,15-didehydro-15,30-dideoxy-5,6-dihydro-17-hydroxy-1-methyl-, (14E)-

Registry Numbers

CAS Registry Number

  • 79190-00-4

System Generated Number

  • 0079190004

Structure Descriptors

InChI

1S/C44H64N2O10/c1-10-12-16-24-36-43(6,7)35(49)28-44(54,56-36)32(11-2)41(52)45-26-20-19-22-30(4)40(55-9)31(5)39(51)34(48)23-18-15-13-14-17-21-29(3)38(50)37-33(47)25-27-46(8)42(37)53/h10,12-24,31-32,34-36,39-40,47-49,51,54H,11,25-28H2,1-9H3,(H,45,52)/b12-10-,15-13+,17-14+,20-19+,23-18+,24-16+,29-21+,30-22+/t31?,32?,34?,35-,36-,39?,40?,44-/m0/s1

InChIKey

GFPYWBPGDHFJDP-PWXLXMISSA-N

Smiles

CCC(C(=O)NC/C=C/C=C(\C)/C(C(C)C(C(/C=C/C=C/C=C/C=C(\C)/C(=O)C1=C(CCN(C1=O)C)O)O)O)OC)[C@@]2(C[C@@H](C([C@@H](O2)/C=C/C=C\C)(C)C)O)O