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Concept information

Preferred term

stephensiolide k  

Type

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

Broader concept

charge

  • 0

formula

  • C34H61N5O9

inchi

  • InChI=1S/C34H61N5O9/c1-7-10-11-12-13-14-15-16-17-18-26(42)37-29-23(6)48-34(47)28(22(5)9-3)39-32(45)27(21(4)8-2)38-31(44)25(20-41)35-30(43)24(19-40)36-33(29)46/h21-25,27-29,40-41H,7-20H2,1-6H3,(H,35,43)(H,36,46)(H,37,42)(H,38,44)(H,39,45)/t21-,22+,23-,24-,25+,27-,28?,29+/m1/s1

inchikey

  • ILMYXIBUNFEXHP-RAGLEDJYSA-N

mass

  • 683.888

monoisotopicmass

  • 683.44693

smiles

  • O=C1O[C@@H]([C@H](NC(=O)CCCCCCCCCCC)C(=O)N[C@@H](C(=O)N[C@H](C(N[C@@H](C(NC1[C@H](CC)C)=O)[C@@H](CC)C)=O)CO)CO)C

subset

  • 2_STAR

synonym EXACT

  • N-[(6R,9S,12R,15S,16R)-6-[(2R)-butan-2-yl]-3-[(2S)-butan-2-yl]-9,12-bis(hydroxymethyl)-16-methyl-2,5,8,11,14-pentaoxo-1-oxa-4,7,10,13-tetrazacyclohexadec-15-yl]dodecanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219976

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