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Concept information

Preferred term

FR235222  

Type

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

Broader concept

charge

  • 0

formula

  • C30H44N4O6

inchi

  • InChI=1S/C30H44N4O6/c1-5-30(4)29(40)32-23(17-21-12-8-6-9-13-21)28(39)34-18-19(2)16-24(34)27(38)31-22(26(37)33-30)14-10-7-11-15-25(36)20(3)35/h6,8-9,12-13,19-20,22-24,35H,5,7,10-11,14-18H2,1-4H3,(H,31,38)(H,32,40)(H,33,37)/t19-,20+,22-,23-,24+,30+/m0/s1

inchikey

  • NJEYLEUCEPGDMG-QSCRDCPQSA-N

mass

  • 556.704

monoisotopicmass

  • 556.32609

smiles

  • O=C1N[C@H](C(=O)N2[C@@H](C(=O)N[C@H](C(N[C@@]1(CC)C)=O)CCCCCC(=O)[C@H](O)C)C[C@@H](C2)C)CC3=CC=CC=C3

subset

  • 2_STAR

synonym EXACT

  • (3S,6R,9S,12R,14S)-3-benzyl-6-ethyl-9-[(7R)-7-hydroxy-6-oxooctyl]-6,14-dimethyl-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:202114

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