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Concept information

Preferred term

اسکداپین بی  

Type

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

charge

  • 0

formula

  • C26H24N4O5

inchi

  • InChI=1S/C26H24N4O5/c1-13-21(32)29-17-11-7-5-9-15(17)25(23(29)27-13)12-18-26(34,35-25)24(2,3)19(31)20-28-16-10-6-4-8-14(16)22(33)30(18)20/h4-11,13,18,23,27,34H,12H2,1-3H3/t13-,18-,23+,25-,26+/m0/s1

inchikey

  • IENYPMZDZJBNMW-CPWGGQKHSA-N

mass

  • 472.501

monoisotopicmass

  • 472.17467

smiles

  • O=C1N2C(=NC3=C1C=CC=C3)C(=O)C(C)(C)[C@]4([C@@H]2C[C@@]5(C6=C(C=CC=C6)N7[C@H]5N[C@@H](C)C7=O)O4)O

subset

  • 2_STAR

synonym EXACT

  • (2'S,3'aR,11S,13S,15S)-15-hydroxy-2',16,16-trimethylspiro[14-oxa-2,10-diazatetracyclo[8.7.0.03,8.011,15]heptadeca-1,3,5,7-tetraene-13,4'-3,3a-dihydro-2H-imidazo[1,2-a]indole]-1',9,17-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:216639

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