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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 > sorbicillactone b
organooxygen compound > carbon oxoacid > carboxylic acid > n-acyl-amino acid > sorbicillactone b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > n-acyl-amino acid > sorbicillactone b
... > 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 > sorbicillactone b
... > 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 > sorbicillactone b
... > 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 > sorbicillactone b
organooxygen compound > carboxamide > n-acyl-amino acid > sorbicillactone b
... > 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 > sorbicillactone b

Preferred term

sorbicillactone b  

Type

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

Broader concept

charge

  • 0

formula

  • C21H25NO8

inchi

  • InChI=1S/C21H25NO8/c1-5-6-7-8-12(23)15-16(27)11(2)18(28)21(4)17(15)20(3,19(29)30-21)22-13(24)9-10-14(25)26/h5-6,9-10,17,27-28H,7-8H2,1-4H3,(H,22,24)(H,25,26)/b6-5+,10-9+/t17-,20+,21+/m1/s1

inchikey

  • FBHQVVAZJLEQBG-NVZCPQDISA-N

mass

  • 419.430

monoisotopicmass

  • 419.15802

smiles

  • O=C1O[C@@]2(C(O)=C(C)C(=C([C@@H]2[C@@]1(NC(=O)/C=C/C(=O)O)C)C(=O)CC/C=C/C)O)C

subset

  • 2_STAR

synonym EXACT

  • (E)-4-[[(3S,3aR,7aS)-4-[(E)-hex-4-enoyl]-5,7-dihydroxy-3,6,7a-trimethyl-2-oxo-3aH-1-benzouran-3-yl]amino]-4-oxobut-2-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:203077

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