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Concept information

Preferred term

میکروکولین ال  

Type

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

Broader concept

charge

  • 0

formula

  • C40H67N5O9

inchi

  • InChI=1S/C40H67N5O9/c1-13-15-16-25(6)19-26(7)37(50)42(11)31(20-24(5)14-2)36(49)41-34(28(9)54-29(10)46)39(52)43(12)35(23(3)4)40(53)44-22-30(47)21-32(44)38(51)45-27(8)17-18-33(45)48/h17-18,23-28,30-32,34-35,47H,13-16,19-22H2,1-12H3,(H,41,49)/t24-,25-,26-,27+,28-,30+,31+,32+,34+,35+/m1/s1

inchikey

  • SVBLJQAMQKXPFK-RTIBGYJGSA-N

mass

  • 762.002

monoisotopicmass

  • 761.49388

smiles

  • O=C1N(C(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](C[C@@H](CCCC)C)C)C)C[C@@H](CC)C)[C@H](OC(=O)C)C)C)C(C)C)C[C@H](C2)O)[C@@H](C)C=C1

subset

  • 2_STAR

synonym EXACT

  • [(2R,3S)-3-[[(2S,4R)-2-[[(2R,4R)-2,4-dimethyloctanoyl]-methylamino]-4-methylhexanoyl]amino]-4-[[(2S)-1-[(2S,4S)-4-hydroxy-2-[(2S)-2-methyl-5-oxo-2H-pyrrole-1-carbonyl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]-methylamino]-4-oxobutan-2-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225368

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