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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 > pnictogen molecular entity > nitrogen molecular entity > ammonium ion derivative > indole alkaloid cation > (3r)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersoninium
... > chemical entity > molecular entity > ion > cation > polyatomic cation > ammonium ion derivative > indole alkaloid cation > (3r)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersoninium
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic cation > ammonium ion derivative > indole alkaloid cation > (3r)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersoninium
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic cation > ammonium ion derivative > indole alkaloid cation > (3r)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersoninium
... > chemical entity > molecular entity > ion > cation > organic cation > indole alkaloid cation > (3r)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersoninium
... > chemical entity > molecular entity > ion > organic ion > organic cation > indole alkaloid cation > (3r)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersoninium
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic ion > organic cation > indole alkaloid cation > (3r)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersoninium

Preferred term

(3r)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersoninium  

Type

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

Broader concept

charge

  • +1

formula

  • C21H25N2O3

inchi

  • InChI=1S/C21H24N2O3/c1-3-19-9-6-11-23-12-10-20(17(19)23)14-7-4-5-8-15(14)22-16(20)21(25,13-19)18(24)26-2/h4-9,17,25H,3,10-13H2,1-2H3/p+1/t17-,19-,20-,21+/m0/s1

inchikey

  • DZPMBJHSZPWWDS-ZIBCJSCZSA-O

is_conjugate_acid_of

mass

  • 353.436

monoisotopicmass

  • 353.18597

smiles

  • [C@@]123C(=NC4=C1C=CC=C4)[C@](C[C@]5([C@@H]2[NH+](CC=C5)CC3)CC)(C(=O)OC)O

subset

  • 3_STAR

synonym EXACT

  • (3beta,5alpha,9beta,12beta,19alpha)-3-hydroxy-3-(methoxycarbonyl)-1,2,6,7-tetradehydroaspidospermidin-9-ium

synonym RELATED

  • (3R)-1,2-didehydro-3-hydroxy-2,3-dihydrotabersonine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:138462

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