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Chemistry, part 1

Content language

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Concept information

organooxygen compound > carbonyl compound > carboxylic acid > n-acyl-amino acid > xiamenmycin a
organooxygen compound > carbon oxoacid > carboxylic acid > n-acyl-amino acid > xiamenmycin a
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > n-acyl-amino acid > xiamenmycin a
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > n-acyl-amino acid > xiamenmycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > amino-acid derivative > n-acyl-amino acid > xiamenmycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > n-acyl-amino acid > xiamenmycin a
organooxygen compound > carboxamide > n-acyl-amino acid > xiamenmycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > n-acyl-amino acid > xiamenmycin a

Preferred term

xiamenmycin a  

Type

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

Broader concept

charge

  • 0

formula

  • C21H29NO6

inchi

  • InChI=1S/C21H29NO6/c1-12(2)6-5-9-21(4)17(24)11-15-10-14(7-8-16(15)28-21)19(25)22-18(13(3)23)20(26)27/h6-8,10,13,17-18,23-24H,5,9,11H2,1-4H3,(H,22,25)(H,26,27)/t13-,17+,18+,21-/m1/s1

inchikey

  • JEQRSDJVWOFRBQ-HTRFZCGXSA-N

mass

  • 391.464

monoisotopicmass

  • 391.19949

smiles

  • O=C(N[C@H](C(=O)O)[C@H](O)C)C1=CC2=C(O[C@@](CCC=C(C)C)(C)[C@H](C2)O)C=C1

subset

  • 2_STAR

synonym EXACT

  • (2S,3R)-3-hydroxy-2-[[(2R,3S)-3-hydroxy-2-methyl-2-(4-methylpent-3-enyl)-3,4-dihydrochromene-6-carbonyl]amino]butanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211361

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