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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 > acetal > ketal > isochromophilone c
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > acetal > ketal > isochromophilone c
... > 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 > acetal > ketal > isochromophilone c

Preferred term

isochromophilone c  

Type

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

Broader concept

charge

  • 0

formula

  • C25H31ClO5

inchi

  • InChI=1S/C25H31ClO5/c1-8-14(2)11-15(3)9-10-17-12-18-19(13-30-17)21-20(16(4)27)25(6,29-7)31-24(21,5)23(28)22(18)26/h9-14,20-21H,8H2,1-7H3/b10-9+,15-11+/t14-,20+,21+,24+,25-/m0/s1

inchikey

  • HVVWQGQUCAAUGE-DTMBAQBYSA-N

mass

  • 446.970

monoisotopicmass

  • 446.18600

smiles

  • ClC1=C2C(=COC(=C2)/C=C/C(=C/[C@H](CC)C)/C)[C@@H]3[C@@H](C(=O)C)[C@](O[C@]3(C1=O)C)(OC)C

subset

  • 2_STAR

synonym EXACT

  • (6aR,8S,9S,9aS)-9-acetyl-5-chloro-3-[(1E,3E,5S)-3,5-dimethylhepta-1,3-dienyl]-8-methoxy-6a,8-dimethyl-9,9a-dihydrouro[2,3-h]isochromen-6-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209100

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