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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > alkaloid > indole alkaloid > methyl (1r,4s,12s,13s,16r,18s)-18-hydroxy-17-oxo-5,14-diazaheptacyclo[12.5.3.01,13.04,12.04,18.06,11.012,16]docosa-6,8,10-triene-5-carboxylate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organonitrogen compound > alkaloid > indole alkaloid > methyl (1r,4s,12s,13s,16r,18s)-18-hydroxy-17-oxo-5,14-diazaheptacyclo[12.5.3.01,13.04,12.04,18.06,11.012,16]docosa-6,8,10-triene-5-carboxylate

Preferred term

methyl (1r,4s,12s,13s,16r,18s)-18-hydroxy-17-oxo-5,14-diazaheptacyclo[12.5.3.01,13.04,12.04,18.06,11.012,16]docosa-6,8,10-triene-5-carboxylate  

Type

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

Broader concept

charge

  • 0

formula

  • C22H24N2O4

inchi

  • InChI=1S/C22H24N2O4/c1-28-18(26)24-15-6-3-2-5-13(15)22-14-11-23-10-4-7-19(17(22)23)8-9-21(22,24)20(27,12-19)16(14)25/h2-3,5-6,14,17,27H,4,7-12H2,1H3/t14-,17+,19-,20-,21-,22-/m1/s1

inchikey

  • YROYAGSZNDUMIF-NXVFQZFNSA-N

mass

  • 380.444

monoisotopicmass

  • 380.17361

smiles

  • O[C@@]12[C@@]34N(C=5C([C@@]36[C@]7(N(C[C@@]6(C1=O)[H])CCC[C@]7(C2)CC4)[H])=CC=CC5)C(OC)=O

subset

  • 2_STAR

synonym EXACT

  • methyl (1R,4S,12S,13S,16R,18S)-18-hydroxy-17-oxo-5,14-diazaheptacyclo[12.5.3.01,13.04,12.04,18.06,11.012,16]docosa-6,8,10-triene-5-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181478

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