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Concept information

Preferred term

کایلوین آ  

Type

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

charge

  • 0

formula

  • C35H63N5O9

inchi

  • InChI=1S/C35H63N5O9/c1-9-11-12-13-14-15-24-18-28(43)36-25(16-20(3)4)31(44)38-27(19-41)33(46)40-30(23(8)42)34(47)37-26(17-21(5)6)32(45)39-29(22(7)10-2)35(48)49-24/h20-27,29-30,41-42H,9-19H2,1-8H3,(H,36,43)(H,37,47)(H,38,44)(H,39,45)(H,40,46)/t22-,23+,24?,25+,26+,27-,29-,30-/m0/s1

inchikey

  • YYMQJCKOEJZMAW-ZKUGEHBFSA-N

mass

  • 697.915

monoisotopicmass

  • 697.46258

smiles

  • O=C1OC(CC(=O)N[C@@H](C(=O)N[C@@H](CO)C(N[C@H](C(N[C@@H](C(N[C@H]1[C@H](CC)C)=O)CC(C)C)=O)[C@H](O)C)=O)CC(C)C)CCCCCCC

subset

  • 2_STAR

synonym EXACT

  • (3S,6R,9S,12S,15R)-3-[(2S)-butan-2-yl]-19-heptyl-9-[(1R)-1-hydroxyethyl]-12-(hydroxymethyl)-6,15-bis(2-methylpropyl)-1-oxa-4,7,10,13,16-pentazacyclononadecane-2,5,8,11,14,17-hexone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199704

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