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Concept information

organooxygen compound > oxacycle > pyrans > pyranone > nigrosporapyrone b

Preferred term

nigrosporapyrone b  

Type

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

Broader concept

charge

  • 0

formula

  • C19H25NO5

inchi

  • InChI=1S/C19H25NO5/c1-11-5-6-12-13(3-2-4-16(12)23)18(11)17-9-15(20-7-8-21)14(10-22)19(24)25-17/h5-6,9-13,16,18,20-21,23H,2-4,7-8H2,1H3/t11-,12+,13+,16+,18+/m0/s1

inchikey

  • RNNBHSZAAMKUBX-CIUFSVDPSA-N

mass

  • 347.411

monoisotopicmass

  • 347.17327

smiles

  • O=C1OC(=CC(=C1C=O)NCCO)[C@H]2[C@H]3[C@@H](C=C[C@@H]2C)[C@H](O)CCC3

subset

  • 2_STAR

synonym EXACT

  • 6-[(1R,2S,4aR,5R,8aR)-5-hydroxy-2-methyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]-4-(2-hydroxyethylamino)-2-oxopyran-3-carbaldehyde

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:198411

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