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Concept information

Preferred term

فوساریسیدین B  

Type

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

charge

  • 0

formula

  • C42H76N10O11

inchi

  • InChI=1S/C42H76N10O11/c1-23(2)32-37(58)50-33(24(3)4)38(59)52-34(26(6)53)39(60)48-29(19-20-30(43)55)36(57)47-25(5)41(62)63-27(7)35(40(61)51-32)49-31(56)22-28(54)18-16-14-12-10-8-9-11-13-15-17-21-46-42(44)45/h23-29,32-35,53-54H,8-22H2,1-7H3,(H2,43,55)(H,47,57)(H,48,60)(H,49,56)(H,50,58)(H,51,61)(H,52,59)(H4,44,45,46)/t25-,26+,27?,28?,29-,32-,33+,34-,35+/m1/s1

inchikey

  • WDNFMLNXGKOBJN-QWDDQTKWSA-N

mass

  • 897.129

monoisotopicmass

  • 896.56950

smiles

  • O=C1OC([C@H](NC(=O)CC(O)CCCCCCCCCCCCN=C(N)N)C(=O)N[C@@H](C(=O)N[C@@H](C(C)C)C(N[C@@H](C(N[C@@H](C(N[C@@H]1C)=O)CCC(=O)N)=O)[C@@H](O)C)=O)C(C)C)C

subset

  • 2_STAR

synonym EXACT

  • N-[(3R,6R,9R,12S,15R,18S)-6-(3-amino-3-oxopropyl)-9-[(1S)-1-hydroxyethyl]-3,19-dimethyl-2,5,8,11,14,17-hexaoxo-12,15-di(propan-2-yl)-1-oxa-4,7,10,13,16-pentazacyclononadec-18-yl]-15-(diaminomethylideneamino)-3-hydroxypentadecanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:198018

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