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Chemistry, part 1

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 > ammonium ion derivative > indole alkaloid cation > 17-o-acetylnorajmaline(1+)
... > chemical entity > molecular entity > ion > cation > polyatomic cation > ammonium ion derivative > indole alkaloid cation > 17-o-acetylnorajmaline(1+)
... > chemical entity > molecular entity > ion > polyatomic ion > polyatomic cation > ammonium ion derivative > indole alkaloid cation > 17-o-acetylnorajmaline(1+)
... > chemical entity > molecular entity > polyatomic entity > polyatomic ion > polyatomic cation > ammonium ion derivative > indole alkaloid cation > 17-o-acetylnorajmaline(1+)
... > chemical entity > molecular entity > ion > cation > organic cation > indole alkaloid cation > 17-o-acetylnorajmaline(1+)
... > chemical entity > molecular entity > ion > organic ion > organic cation > indole alkaloid cation > 17-o-acetylnorajmaline(1+)
... > 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 > 17-o-acetylnorajmaline(1+)

Preferred term

17-o-acetylnorajmaline(1+)  

Type

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

Broader concept

charge

  • +1

formula

  • C21H27N2O3

inchi

  • InChI=1S/C21H26N2O3/c1-3-11-12-8-15-18-21(13-6-4-5-7-14(13)22-18)9-16(23(15)20(11)25)17(12)19(21)26-10(2)24/h4-7,11-12,15-20,22,25H,3,8-9H2,1-2H3/p+1/t11-,12-,15-,16-,17?,18-,19+,20+,21+/m0/s1

inchikey

  • VAOXSMUPPRUEKF-VFHMDEBLSA-O

is_conjugate_acid_of

mass

  • 355.45010

monoisotopicmass

  • 355.20162

smiles

  • CC[C@@H]1[C@@H](O)[NH+]2[C@H]3C[C@]45[C@@H](Nc6ccccc46)[C@@H]2C[C@@H]1C3[C@H]5OC(C)=O

subset

  • 3_STAR

synonym EXACT

  • (2beta,7beta,16xi,17R,20beta,21alpha)-21-hydroxy-2,7,19,20-tetrahydro-7,17-cyclosarpagan-4-ium-17-yl acetate

synonym RELATED

  • 17-O-acetylnorajmaline

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:77725

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