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Chemistry, part 1

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Concept information

... > organooxygen compound > ester > carboxylic ester > amino-acid ester > alpha-amino acid ester > methyl (3ar,6r,6as)-6-[(s)-[(1s)-cyclohex-2-en-1-yl]-hydroxymethyl]-6a-methyl-4-oxo-2,3,3a,5-tetrahydrouro[2,3-c]pyrrole-6-carboxylate
... > organooxygen compound > carbonyl compound > carboxylic ester > amino-acid ester > alpha-amino acid ester > methyl (3ar,6r,6as)-6-[(s)-[(1s)-cyclohex-2-en-1-yl]-hydroxymethyl]-6a-methyl-4-oxo-2,3,3a,5-tetrahydrouro[2,3-c]pyrrole-6-carboxylate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > amino-acid derivative > amino-acid ester > alpha-amino acid ester > methyl (3ar,6r,6as)-6-[(s)-[(1s)-cyclohex-2-en-1-yl]-hydroxymethyl]-6a-methyl-4-oxo-2,3,3a,5-tetrahydrouro[2,3-c]pyrrole-6-carboxylate

Preferred term

methyl (3ar,6r,6as)-6-[(s)-[(1s)-cyclohex-2-en-1-yl]-hydroxymethyl]-6a-methyl-4-oxo-2,3,3a,5-tetrahydrouro[2,3-c]pyrrole-6-carboxylate  

Type

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

Broader concept

charge

  • 0

formula

  • C16H23NO5

inchi

  • InChI=1S/C16H23NO5/c1-15-11(8-9-22-15)13(19)17-16(15,14(20)21-2)12(18)10-6-4-3-5-7-10/h4,6,10-12,18H,3,5,7-9H2,1-2H3,(H,17,19)/t10-,11+,12+,15+,16+/m1/s1

inchikey

  • WDIRUGQHYYJBHM-BFPXCNAZSA-N

mass

  • 309.362

monoisotopicmass

  • 309.15762

smiles

  • O=C1N[C@](C(=O)OC)([C@@H](O)[C@@H]2C=CCCC2)[C@@]3([C@H]1CCO3)C

subset

  • 2_STAR

synonym EXACT

  • methyl (3aR,6R,6aS)-6-[(S)-[(1S)-cyclohex-2-en-1-yl]-hydroxymethyl]-6a-methyl-4-oxo-2,3,3a,5-tetrahydrouro[2,3-c]pyrrole-6-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223642

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