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Chemistry, part 1

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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 amino compound > tertiary amino compound > 19-o-acetylhoerhammericine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > tertiary amino compound > 19-o-acetylhoerhammericine
organooxygen compound > ester > carboxylic ester > methyl ester > 19-o-acetylhoerhammericine
organooxygen compound > carbonyl compound > carboxylic ester > methyl ester > 19-o-acetylhoerhammericine
organooxygen compound > ester > carboxylic ester > acetate ester > 19-o-acetylhoerhammericine
organooxygen compound > carbonyl compound > carboxylic ester > acetate ester > 19-o-acetylhoerhammericine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > secondary amino compound > 19-o-acetylhoerhammericine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > secondary amino compound > 19-o-acetylhoerhammericine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > alkaloid > indole alkaloid > aspidosperma alkaloid > 19-o-acetylhoerhammericine

Preferred term

19-o-acetylhoerhammericine  

Type

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

Broader concept

charge

  • 0

formula

  • C23H26N2O5

has_functional_parent

inchi

  • InChI=1S/C23H26N2O5/c1-12(29-13(2)26)23-10-14(20(27)28-3)18-22(15-6-4-5-7-16(15)24-18)8-9-25(21(22)23)11-17-19(23)30-17/h4-7,12,17,19,21,24H,8-11H2,1-3H3/t12-,17+,19+,21-,22+,23+/m1/s1

inchikey

  • UHJSNZNSAVJLSA-TZQKRGQNSA-N

is_conjugate_base_of

mass

  • 410.470

monoisotopicmass

  • 410.18417

smiles

  • C=1(C[C@]2([C@@]3(N(C[C@H]4[C@@H]2O4)CC[C@]53C6=C(NC51)C=CC=C6)[H])[C@@H](C)OC(=O)C)C(=O)OC

subset

  • 3_STAR

synonym EXACT

  • methyl (20R)-20-acetoxy-5alpha,6alpha,7alpha,12beta,19alpha-2,3-didehydro-6,7-epoxyaspidospermidine-3-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:145333

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