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Concept information

Preferred term

rotihibin c  

Type

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

Broader concept

charge

  • 0

formula

  • C36H65N11O13

inchi

  • InChI=1S/C36H65N11O13/c1-4-5-6-7-8-9-10-13-25(52)44-22(12-11-15-42-36(40)60)31(55)46-27(20(3)50)34(58)45-23(14-16-41-33(57)26(38)19(2)49)32(56)47-28(29(53)30(39)54)35(59)43-21(18-48)17-24(37)51/h10,13,19-23,26-29,48-50,53H,4-9,11-12,14-18,38H2,1-3H3,(H2,37,51)(H2,39,54)(H,41,57)(H,43,59)(H,44,52)(H,45,58)(H,46,55)(H,47,56)(H3,40,42,60)/b13-10-

inchikey

  • RENUJGDPFXSMFV-RAXLEYEMSA-N

mass

  • 859.980

monoisotopicmass

  • 859.47633

smiles

  • O=C(NCCCC(NC(=O)/C=C/CCCCCCC)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CO)CC(=O)N)C(O)C(=O)N)CCNC(=O)C(N)C(O)C)C(O)C)N

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:222246

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