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Concept information

Preferred term

2,3 seco 2,3 dioxo lyngbyatoxin A  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C27H39N3O4

inchi

  • InChI=1S/C27H39N3O4/c1-8-27(6,13-9-10-17(2)3)20-11-12-21-23(24(20)28-16-32)22(33)14-19(15-31)29-26(34)25(18(4)5)30(21)7/h8,10-12,16,18-19,25,31H,1,9,13-15H2,2-7H3,(H,28,32)(H,29,34)/t19-,25-,27-/m0/s1

inchikey

  • JYUKIYQJAAZEOB-BYGVMDBSSA-N

mass

  • 469.626

monoisotopicmass

  • 469.29406

smiles

  • O=C1N[C@@H](CC(=O)C2=C(N([C@H]1C(C)C)C)C=CC(=C2NC=O)[C@@](C=C)(CCC=C(C)C)C)CO

subset

  • 2_STAR

synonym EXACT

  • N-[(2S,5S)-9-[(3R)-3,7-dimethylocta-1,6-dien-3-yl]-5-(hydroxymethyl)-1-methyl-3,7-dioxo-2-propan-2-yl-2,4,5,6-tetrahydro-1,4-benzodiazonin-8-yl]ormamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227658

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