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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

mohangic acid e  

Type

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

Broader concept

charge

  • 0

formula

  • C32H47NO11

inchi

  • InChI=1S/C32H47NO11/c1-18(8-6-4-5-7-9-23(35)15-27(38)39)28(40)20(3)14-19(2)24(36)16-25(37)21-10-12-22(13-11-21)33-32-31(43)30(42)29(41)26(17-34)44-32/h4-13,18-20,23-24,26,28-36,40-43H,14-17H2,1-3H3,(H,38,39)/b5-4+,8-6+,9-7+/t18-,19-,20-,23+,24-,26-,28-,29-,30+,31-,32-/m1/s1

inchikey

  • FKOZUOZLANCREK-VZHUOFTASA-N

mass

  • 621.724

monoisotopicmass

  • 621.31491

smiles

  • O=C(O)C[C@@H](O)/C=C/C=C/C=C/[C@H]([C@@H](O)[C@@H](C[C@H]([C@H](O)CC(=O)C1=CC=C(N[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)C=C1)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (3R,4E,6E,8E,10R,11S,12R,14R,15R)-3,11,15-trihydroxy-10,12,14-trimethyl-17-oxo-17-[4-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]phenyl]heptadeca-4,6,8-trienoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:227248

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