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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > varioxiranol e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > varioxiranol e
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > varioxiranol e

Preferred term

varioxiranol e  

Type

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

Broader concept

charge

  • 0

formula

  • C16H20O7

inchi

  • InChI=1S/C16H20O7/c1-9(18)14-15(23-16(20)22-14)12(19)7-6-10-4-3-5-13(21-2)11(10)8-17/h3-7,9,12,14-15,17-19H,8H2,1-2H3/b7-6+/t9-,12+,14-,15+/m0/s1

inchikey

  • RIMJYAIXPPJLSM-DHAMEPLPSA-N

mass

  • 324.329

monoisotopicmass

  • 324.12090

smiles

  • O=C1O[C@H]([C@H](O)/C=C/C2=C(C(OC)=CC=C2)CO)[C@@H](O1)[C@@H](O)C

subset

  • 2_STAR

synonym EXACT

  • (4S,5R)-4-[(1S)-1-hydroxyethyl]-5-[(E,1R)-1-hydroxy-3-[2-(hydroxymethyl)-3-methoxyphenyl]prop-2-enyl]-1,3-dioxolan-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210247

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