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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > ester > carboxylic ester > benzoate ester > 4-hydroxybenzoate ester > orsellinylmontagnetol b
... > organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > 4-hydroxybenzoate ester > orsellinylmontagnetol b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > phenols > 4-hydroxybenzoate ester > orsellinylmontagnetol b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > 4-hydroxybenzoate ester > orsellinylmontagnetol b
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > organic hydroxy compound > phenols > 4-hydroxybenzoate ester > orsellinylmontagnetol b
organic aromatic compound > phenols > 4-hydroxybenzoate ester > orsellinylmontagnetol b

Preferred term

orsellinylmontagnetol b  

Type

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

Broader concept

charge

  • 0

formula

  • C20H22O10

inchi

  • InChI=1S/C20H22O10/c1-9-3-11(22)5-13(24)17(9)19(27)29-8-15(26)16(7-21)30-20(28)18-10(2)4-12(23)6-14(18)25/h3-6,15-16,21-26H,7-8H2,1-2H3/t15-,16+/m1/s1

inchikey

  • JBPYESXXRDZADY-CVEARBPZSA-N

mass

  • 422.386

monoisotopicmass

  • 422.12130

smiles

  • O=C(O[C@H]([C@H](O)COC(=O)C1=C(O)C=C(O)C=C1C)CO)C2=C(O)C=C(O)C=C2C

subset

  • 2_STAR

synonym EXACT

  • [(2R,3S)-3-(2,4-dihydroxy-6-methylbenzoyl)oxy-2,4-dihydroxybutyl] 2,4-dihydroxy-6-methylbenzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214704

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