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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > phenols > 11-methoxy-17-formyl-17-demethoxy-18-o-21-o-dihydrogeldanamycin
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > 11-methoxy-17-formyl-17-demethoxy-18-o-21-o-dihydrogeldanamycin
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > 11-methoxy-17-formyl-17-demethoxy-18-o-21-o-dihydrogeldanamycin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > phenols > 11-methoxy-17-formyl-17-demethoxy-18-o-21-o-dihydrogeldanamycin
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > 11-methoxy-17-formyl-17-demethoxy-18-o-21-o-dihydrogeldanamycin

Preferred term

11-methoxy-17-formyl-17-demethoxy-18-o-21-o-dihydrogeldanamycin  

Type

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

Broader concept

charge

  • 0

formula

  • C30H42N2O9

inchi

  • InChI=1S/C30H42N2O9/c1-16-11-20-21(15-33)23(34)14-22(26(20)35)32-29(36)17(2)9-8-10-24(38-5)28(41-30(31)37)19(4)13-18(3)27(40-7)25(12-16)39-6/h8-10,13-16,18,24-25,27-28,34-35H,11-12H2,1-7H3,(H2,31,37)(H,32,36)/b10-8-,17-9-,19-13-/t16-,18-,24-,25-,27+,28-/m0/s1

inchikey

  • HQFCNCFMYXBIIK-ZKKBMTTCSA-N

mass

  • 574.671

monoisotopicmass

  • 574.28903

smiles

  • O=C1NC2=C(O)C(=C(C=O)C(=C2)O)C[C@@H](C[C@H](OC)[C@H](OC)[C@H](C=C([C@@H]([C@H](C=CC=C1C)OC)OC(=O)N)C)C)C

subset

  • 2_STAR

synonym EXACT

  • [(4Z,6Z,8S,9S,10Z,12S,13R,14S,16S)-19-ormyl-20,22-dihydroxy-8,13,14-trimethoxy-4,10,12,16-tetramethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(21),4,6,10,18(22),19-hexaen-9-yl] carbamate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:198726

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