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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > phenols > vaccinol a
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > vaccinol a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > vaccinol 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 > phenols > vaccinol a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > vaccinol a

Preferred term

vaccinol a  

Type

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

Broader concept

charge

  • 0

formula

  • C17H20O3

inchi

  • InChI=1S/C17H20O3/c1-10(2)4-5-12-6-8-14(18)16-13(12)7-9-15-11(3)19-17(16)20-15/h4,6-9,11,15,17-18H,5H2,1-3H3/t11-,15-,17+/m0/s1

inchikey

  • SIHDWOBVGPXLHQ-XNJJOIOASA-N

mass

  • 272.344

monoisotopicmass

  • 272.14124

smiles

  • O1[C@H]2O[C@H]([C@@H]1C=CC3=C2C(O)=CC=C3CC=C(C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,10S,11S)-11-methyl-6-(3-methylbut-2-enyl)-12,13-dioxatricyclo[8.2.1.02,7]trideca-2,4,6,8-tetraen-3-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200475

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