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Concept information

Preferred term

QN تریوستین A  

Type

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

charge

  • 0

formula

  • C52H64N10O12S2

inchi

  • InChI=1S/C52H64N10O12S2/c1-27(2)41-51(71)73-23-37(57-43(63)33-19-31-15-11-13-17-35(31)53-21-33)45(65)55-30(6)48(68)60(8)40-26-76-75-25-39(49(69)61(41)9)59(7)47(67)29(5)56-46(66)38(24-74-52(72)42(28(3)4)62(10)50(40)70)58-44(64)34-20-32-16-12-14-18-36(32)54-22-34/h11-22,27-30,37-42H,23-26H2,1-10H3,(H,55,65)(H,56,66)(H,57,63)(H,58,64)

inchikey

  • LZFWSUQFHUIRQQ-UHFFFAOYSA-N

mass

  • 1085.260

monoisotopicmass

  • 1084.41466

smiles

  • S1SCC2N(C(=O)C(NC(=O)C(NC(=O)C=3C=NC4=CC=CC=C4C3)COC(C(N(C(C(C1)N(C(=O)C(NC(=O)C(NC(=O)C=5C=NC6=CC=CC=C6C5)COC(C(N(C2=O)C)C(C)C)=O)C)C)=O)C)C(C)C)=O)C)C

subset

  • 2_STAR

synonym EXACT

  • N-[2,4,12,15,17,25-hexamethyl-3,6,10,13,16,19,23,26-octaoxo-11,24-di(propan-2-yl)-20-(quinoline-3-carbonylamino)-9,22-dioxa-28,29-dithia-2,5,12,15,18,25-hexazabicyclo[12.12.4]triacontan-7-yl]quinoline-3-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217095

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