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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 > alcohol > aliphatic alcohol > isopenicillstrebetaol
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > aliphatic alcohol > isopenicillstrebetaol

Preferred term

isopenicillstrebetaol  

Type

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

Broader concept

charge

  • 0

formula

  • C23H30O7

inchi

  • InChI=1S/C23H30O7/c1-13(20-23(5)21(26)22(4,30-20)15(3)29-23)10-8-7-9-11-16(24)19-14(2)17(27-6)12-18(25)28-19/h7-12,15-16,20-21,24,26H,1-6H3/b8-7+,11-9+,13-10+/t15-,16?,20-,21?,22+,23+/m1/s1

inchikey

  • FVGGRTZBOSGBFB-VCUDSOAYSA-N

mass

  • 418.486

monoisotopicmass

  • 418.19915

smiles

  • O=C1OC(=C(C)C(=C1)OC)C(O)/C=C/C=C/C=C(/[C@H]2O[C@]3([C@@H](C)O[C@@]2(C3O)C)C)/C

subset

  • 2_STAR

synonym EXACT

  • 6-[(2E,4E,6E)-1-hydroxy-7-[(1R,3R,4R,6R)-7-hydroxy-1,4,6-trimethyl-2,5-dioxabicyclo[2.2.1]heptan-3-yl]octa-2,4,6-trienyl]-4-methoxy-5-methylpyran-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:207565

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