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Chemistry, part 3

Content language

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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 > chaetoindicin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > carbonyl compound > ketone > aromatic ketone > chaetoindicin b
... > 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 > chaetoindicin b
... > 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 > chaetoindicin b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > aromatic ketone > chaetoindicin b

Preferred term

chaetoindicin b  

Type

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

Broader concept

charge

  • 0

formula

  • C16H19NO4

inchi

  • InChI=1S/C16H19NO4/c1-8-5-11-10(7-17-8)13(18)9(2)14-16(11,20)6-12(21-14)15(3,4)19/h5,7,12,19-20H,6H2,1-4H3/t12-,16+/m0/s1

inchikey

  • XKFSBTUQCGMWKU-BLLLJJGKSA-N

mass

  • 289.331

monoisotopicmass

  • 289.13141

smiles

  • O=C1C2=C(C=C(C)N=C2)[C@]3(O)C[C@H](OC3=C1C)C(O)(C)C

subset

  • 2_STAR

synonym EXACT

  • (2S,9bR)-9b-hydroxy-2-(2-hydroxypropan-2-yl)-4,8-dimethyl-1,2-dihydrouro[3,2-]isoquinolin-5-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217622

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