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Concept information

Preferred term

آکرمولاکتون B  

Type

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

Broader concept

charge

  • 0

formula

  • C26H31NO5

inchi

  • InChI=1S/C26H31NO5/c1-5-6-9-15(3)23(29)20-21-18-13-27-22(16-11-8-7-10-14(16)2)24(30)17(18)12-19(28)26(21,4)32-25(20)31/h7-11,13,19-21,23,28-30H,5-6,12H2,1-4H3/b15-9+/t19-,20-,21+,23+,26+/m0/s1

inchikey

  • PGFXNTBJNUFXCN-YRANEMMESA-N

mass

  • 437.536

monoisotopicmass

  • 437.22022

smiles

  • O=C1O[C@@]2([C@@H](O)CC3=C([C@@H]2[C@H]1[C@H](O)/C(=C/CCC)/C)C=NC(=C3O)C4=C(C=CC=C4)C)C

subset

  • 2_STAR

synonym EXACT

  • (6S,6aS,9S,9aS)-4,6-dihydroxy-9-[(E,1S)-1-hydroxy-2-methylhex-2-enyl]-6a-methyl-3-(2-methylphenyl)-5,6,9,9a-tetrahydrouro[2,3-h]isoquinolin-8-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199131

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