skip to main content

Chemistry, part 3

Content language

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

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > carbonyl compound > ketone > aromatic ketone > (-)-applanatumol e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > (-)-applanatumol e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > (-)-applanatumol e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > (-)-applanatumol e
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > (-)-applanatumol e

Preferred term

(-)-applanatumol e  

Type

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

Broader concept

charge

  • 0

formula

  • C18H22O8

inchi

  • InChI=1S/C18H22O8/c1-24-16(25-2)18-9-26-15(23)17(18,6-5-14(18)22)8-13(21)11-7-10(19)3-4-12(11)20/h3-4,7,14,16,19-20,22H,5-6,8-9H2,1-2H3/t14-,17+,18-/m0/s1

inchikey

  • VCCZNZDGMFCWPD-QGTPRVQTSA-N

mass

  • 366.366

monoisotopicmass

  • 366.13147

smiles

  • O=C1OC[C@@]2([C@]1(CC[C@@H]2O)CC(=O)C3=C(O)C=CC(=C3)O)C(OC)OC

subset

  • 2_STAR

synonym EXACT

  • (3aS,6S,6aR)-3a-[2-(2,5-dihydroxyphenyl)-2-oxoethyl]-6a-(dimethoxymethyl)-6-hydroxy-1,4,5,6-tetrahydrocyclopenta[c]uran-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225549

Download this concept:

RDF/XML TURTLE JSON-LD