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Concept information

Preferred term

GE2270A  

Type

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

alt_id

  • CHEBI:42746

charge

  • 0

formula

  • C56H55N15O10S6

inchi

  • InChI=1S/C56H55N15O10S6/c1-24(2)39-55-70-42(36(87-55)19-80-5)47(77)59-17-38(73)67-43(44(74)26-10-7-6-8-11-26)54-66-34(23-85-54)52-63-31(20-83-52)41-27(50-64-32(21-82-50)46(76)61-29(16-37(72)58-4)53-69-40(25(3)86-53)48(78)68-39)13-14-28(60-41)51-65-33(22-84-51)49-62-30(18-81-49)56(79)71-15-9-12-35(71)45(57)75/h6-8,10-11,13-14,20-24,29-30,35,39,43-44,74H,9,12,15-19H2,1-5H3,(H2,57,75)(H,58,72)(H,59,77)(H,61,76)(H,67,73)(H,68,78)

inchikey

  • JMDULECOHIXMNX-UHFFFAOYSA-N

mass

  • 1290.510

monoisotopicmass

  • 1289.25806

smiles

  • C=1(COC)SC=2C(NC(=O)C3=C(SC(C(NC(=O)C4=CSC(=N4)C=5C=CC(C=6SC=C(N6)C=7OCC(C(N8C(CCC8)C(N)=O)=O)N7)=NC5C=9N=C(SC9)C=%10N=C(C(NC(CNC(C1N2)=O)=O)C(C%11=CC=CC=C%11)O)SC%10)CC(NC)=O)=N3)C)C(C)C

subset

  • 2_STAR

synonym EXACT

  • GE2270A

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:29584

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