NSC279503

Show simple item record

dc.creatorUS National Cancer Instituteen_GB
dc.date.accessioned2006-05-02T12:07:45Z
dc.date.available2006-05-02T12:07:45Z
dc.date.created2003-02-01en_GB
dc.date.issued2006-05-02T12:07:45Z
dc.identifierNSC279503en_GB
dc.identifier.urihttp://www.dspace.cam.ac.uk/handle/1810/157380
dc.format.extent10719 bytes
dc.format.extent9098 bytes
dc.format.mimetypechemical/x-cml
dc.format.mimetypechemical/x-cml
dc.language.isoen_GB
dc.publisherUnilever Center for Molecular Informatics, Cambridge Universityen_GB
dc.titleNSC279503en_GB
dc.title.alternativeISOBRUCEIN Aen_GB
dc.title.alternativePicras-3-en-21-oic acid, 13,20-epoxy-1,11, 12-trihydroxy-15-(3-methyl-1-oxobutoxy)-2,16-dioxo-, methyl ester, (1.beta.,11.beta.,12.alpha.,15.beta.)-en_GB
dc.title.alternativePicras-4-en-21-oic acid, 13,20-epoxy-1,11,12-trihydroxy-15-(3-methyl-1-oxobutoxy)-2, 16-dioxo-, methyl esteren_GB
dc.typeChemical Structuresen_GB
dc.identifier.inchikeyNTBOLWMPXFGUHO-BQXSYECWSA-N
dc.identifier.inchiInChI=1S/C26H34O11/c1-10(2)6-15(28)37-17-19-25-9-35-26(19,23(33)34-5)21(31)16(29)18(25)24(4)12(8-14(25)36-22(17)32)11(3)7-13(27)20(24)30/h7,10,12,14,16-21,29-31H,6,8-9H2,1-5H3/t12-,14+,16-,17-,18-,19-,20-,21-,24-,25+,26-/m0/s1
dc.identifier.ichiC26H34O11,1H3-10-6H-11(27)19H(31H)24(4H3)16H(10)8H2-17H-25-9H2-35-26(14(30)34-5H3,23H(33H)20H(32H)22H(24)25)21H(25)18H(13(29)37-17)36-12(28)7H2-15H(2H3)3H3en_GB


Files in this item

Thumbnail
Name:
nsc279503_original.cml
Size:
10Kb
Format:
chemical/x-cml
View / Open Files
Thumbnail
Name:
nsc279503_post-mopac.cml
Size:
8Kb
Format:
chemical/x-cml
View / Open Files

This item appears in the following Collection(s)

  • WWMM
    The WorldWideMolecularMatrix, an Open collection of information on small molecules

Show simple item record