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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ether > aromatic ether > alpha-collatolic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > aromatic ether > alpha-collatolic acid
... > 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 > aromatic ether > alpha-collatolic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > aromatic ether > alpha-collatolic acid

Preferred term

alpha-collatolic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C29H34O9

inchi

  • InChI=1S/C29H34O9/c1-4-6-8-10-18(30)12-17-13-20(36-3)15-23-25(17)29(35)38-24-16-22(32)26(28(33)34)21(27(24)37-23)14-19(31)11-9-7-5-2/h13,15-16,32H,4-12,14H2,1-3H3,(H,33,34)

inchikey

  • QLTNFHFQLMFRBN-UHFFFAOYSA-N

mass

  • 526.576

monoisotopicmass

  • 526.220

smiles

  • O=C1OC2=C(C(=C(C(=O)O)C(=C2)O)CC(=O)CCCCC)OC3=C1C(=CC(=C3)OC)CC(=O)CCCCC

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:144111

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