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Chemistry, part 2

Content language

Contact us: CRM@email.irandoc.ac.ir

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 > (r)-3-hydroxy-1-[(s)-4-hydroxy-1,3-dihydroisobenzofuran-1-yl]butan-2-one
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > (r)-3-hydroxy-1-[(s)-4-hydroxy-1,3-dihydroisobenzofuran-1-yl]butan-2-one
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > (r)-3-hydroxy-1-[(s)-4-hydroxy-1,3-dihydroisobenzofuran-1-yl]butan-2-one
... > 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 > (r)-3-hydroxy-1-[(s)-4-hydroxy-1,3-dihydroisobenzofuran-1-yl]butan-2-one
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > (r)-3-hydroxy-1-[(s)-4-hydroxy-1,3-dihydroisobenzofuran-1-yl]butan-2-one

Preferred term

(r)-3-hydroxy-1-[(s)-4-hydroxy-1,3-dihydroisobenzofuran-1-yl]butan-2-one  

Type

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

Broader concept

charge

  • 0

formula

  • C12H14O4

has_role

inchi

  • InChI=1S/C12H14O4/c1-7(13)11(15)5-12-8-3-2-4-10(14)9(8)6-16-12/h2-4,7,12-14H,5-6H2,1H3/t7-,12+/m1/s1

inchikey

  • BBGDMJGYFNHPDK-KRTXAFLBSA-N

mass

  • 222.23720

monoisotopicmass

  • 222.08921

smiles

  • C[C@@H](O)C(=O)C[C@@H]1OCc2c(O)cccc12

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69695

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