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Concept information

Preferred term

(8S,8a R) 7 Deacetyl 5 dechloro 1,O8,8,8a tetrahydro 7 epi sclerotiorin  

Type

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

Broader concept

charge

  • 0

formula

  • C19H26O4

inchi

  • InChI=1S/C19H26O4/c1-5-12(2)8-13(3)6-7-15-9-14-10-17(20)19(4,22)18(21)16(14)11-23-15/h6-10,12,16,18,21-22H,5,11H2,1-4H3/b7-6+,13-8+/t12-,16+,18-,19+/m0/s1

inchikey

  • CDNUINONZTWWCE-ODWUICSLSA-N

mass

  • 318.413

monoisotopicmass

  • 318.18311

smiles

  • O=C1C=C2C=C(OC[C@H]2[C@@H]([C@@]1(O)C)O)/C=C/C(=C/[C@H](CC)C)/C

subset

  • 2_STAR

synonym EXACT

  • (7S,8S,8aS)-3-[(1E,3E,5S)-3,5-dimethylhepta-1,3-dienyl]-7,8-dihydroxy-7-methyl-8,8a-dihydro-1H-isochromen-6-one

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215731

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