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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > phenols > hydroxybenzaldehyde > penicipyran e
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > hydroxybenzaldehyde > penicipyran e
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > phenols > hydroxybenzaldehyde > penicipyran e
organic aromatic compound > phenols > hydroxybenzaldehyde > penicipyran e
... > organooxygen compound > carbonyl compound > aldehyde > arenecarbaldehyde > benzaldehydes > hydroxybenzaldehyde > penicipyran e
organic aromatic compound > arenecarbaldehyde > benzaldehydes > hydroxybenzaldehyde > penicipyran e

Preferred term

penicipyran e  

Type

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

Broader concept

charge

  • 0

formula

  • C15H16O4

inchi

  • InChI=1S/C15H16O4/c1-9-4-3-5-12(19-9)6-11-7-14(17)10(2)15(18)13(11)8-16/h3,5-9,17-18H,4H2,1-2H3/t9-/m0/s1

inchikey

  • YUNYOSJRYNLHEN-VIFPVBQESA-N

mass

  • 260.289

monoisotopicmass

  • 260.10486

smiles

  • O=CC1=C(O)C(=C(O)C=C1C=C2O[C@H](CC=C2)C)C

subset

  • 2_STAR

synonym EXACT

  • 2,4-dihydroxy-3-methyl-6-[[(2S)-2-methyl-2,3-dihydropyran-6-ylidene]methyl]benzaldehyde

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212272

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