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Concept information

Preferred term

aigialospirol  

Type

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

Broader concept

charge

  • 0

formula

  • C19H22O8

inchi

  • InChI=1S/C19H22O8/c1-9-4-3-5-19(26-9)17(22)13(21)8-14(27-19)16-11-6-10(24-2)7-12(20)15(11)18(23)25-16/h3,5-7,9,13-14,16-17,20-22H,4,8H2,1-2H3/t9-,13-,14+,16-,17-,19+/m0/s1

inchikey

  • XOJJZYZCRNGOFV-YLZOTCFESA-N

mass

  • 378.377

monoisotopicmass

  • 378.13147

smiles

  • O=C1O[C@H]([C@@H]2O[C@@]3(O[C@H](CC=C3)C)[C@@H](O)[C@H](C2)O)C=4C1=C(O)C=C(OC)C4

subset

  • 2_STAR

synonym EXACT

  • (3S)-3-[(2R,4S,5S,6R,8S)-4,5-dihydroxy-8-methyl-1,7-dioxaspiro[5.5]undec-10-en-2-yl]-7-hydroxy-5-methoxy-3H-2-benzouran-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201251

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