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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 2s,4s-spinosate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > 2s,4s-spinosate
... > 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 > ketone > aromatic ketone > 2s,4s-spinosate
... > 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 > ketone > aromatic ketone > 2s,4s-spinosate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > 2s,4s-spinosate

Preferred term

2s,4s-spinosate  

Type

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

Broader concept

charge

  • 0

formula

  • C15H20O7

inchi

  • InChI=1S/C15H20O7/c1-8(16)9-5-6-10(17)13(14(9)18)11(20-2)7-12(21-3)15(19)22-4/h5-6,11-12,17-18H,7H2,1-4H3/t11-,12-/m0/s1

inchikey

  • NMXDMNJYPIEYAT-RYUDHWBXSA-N

mass

  • 312.318

monoisotopicmass

  • 312.12090

smiles

  • O=C(OC)[C@@H](OC)C[C@H](OC)C1=C(O)C(C(=O)C)=CC=C1O

subset

  • 2_STAR

synonym EXACT

  • methyl (2S,4S)-4-(3-acetyl-2,6-dihydroxyphenyl)-2,4-dimethoxybutanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200331

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