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Chemistry, part 3

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > erinacerin o
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > erinacerin o
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > erinacerin o
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > erinacerin o
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > erinacerin o

Preferred term

erinacerin o  

Type

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

Broader concept

charge

  • 0

formula

  • C19H28N2O6

inchi

  • InChI=1S/C19H28N2O6/c1-6-11(4)17(25)16(19(26)27)20-18(10(2)3)21-8-14(12(5)23)15(24)7-13(21)9-22/h7-8,10-11,17-18,22,25H,6,9H2,1-5H3,(H,26,27)/t11?,17-,18-/m0/s1

inchikey

  • XELPLZCCFQVOFX-AZOLZQDUSA-N

mass

  • 380.441

monoisotopicmass

  • 380.19474

smiles

  • O=C1C(C(=O)C)=CN([C@H](N=C(C(=O)O)[C@@H](O)C(CC)C)C(C)C)C(=C1)CO

subset

  • 2_STAR

synonym EXACT

  • (3S)-2-[(1R)-1-[5-acetyl-2-(hydroxymethyl)-4-oxopyridin-1-yl]-2-methylpropyl]imino-3-hydroxy-4-methylhexanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212842

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