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Concept information

Preferred term

cytochalasin b6  

Type

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

Broader concept

charge

  • 0

formula

  • C29H37NO5

inchi

  • InChI=1S/C29H37NO5/c1-18-9-7-13-22(31)15-16-25(32)35-29-23(14-8-10-18)27(33)20(3)19(2)26(29)24(30-28(29)34)17-21-11-5-4-6-12-21/h4-6,8,11-12,14,18-19,23-24,26-27,33H,3,7,9-10,13,15-17H2,1-2H3,(H,30,34)/b14-8+/t18-,19-,23+,24+,26+,27-,29-/m1/s1

inchikey

  • WXIPPGRNMKMGML-YPCMEHOXSA-N

mass

  • 479.617

monoisotopicmass

  • 479.26717

smiles

  • O=C1O[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C([C@H]([C@@H]3C=CC[C@H](C)CCCC(CC1)=O)O)=C)CC4=CC=CC=C4

subset

  • 2_STAR

synonym EXACT

  • (1S,10R,12E,14S,15S,17S,18S,19S)-19-benzyl-15-hydroxy-10,17-dimethyl-16-methylidene-2-oxa-20-azatricyclo[12.7.0.01,18]henicos-12-ene-3,6,21-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:218954

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