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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenylpropanoid > circumcin a
... > 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 > circumcin a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenylpropanoid > circumcin a

Preferred term

circumcin a  

Type

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

Broader concept

charge

  • 0

formula

  • C16H18O3

inchi

  • InChI=1S/C16H18O3/c17-14-8-6-13(7-9-14)11-16(19)15(18)10-12-4-2-1-3-5-12/h1-9,15-19H,10-11H2/t15-,16-/m0/s1

inchikey

  • PMXBRVFRYDNFJZ-HOTGVXAUSA-N

mass

  • 258.317

monoisotopicmass

  • 258.12559

smiles

  • OC1=CC=C(C[C@H](O)[C@@H](O)CC2=CC=CC=C2)C=C1

subset

  • 2_STAR

synonym EXACT

  • (2S,3S)-1-(4-hydroxyphenyl)-4-phenylbutane-2,3-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215724

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