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Concept information

Preferred term

آسپرفنالنون E  

Type

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

Broader concept

charge

  • 0

formula

  • C35H46O9

inchi

  • InChI=1S/C35H46O9/c1-19(11-8-12-23(18-36)13-14-25(38)34(5,6)43)9-7-10-20(2)15-16-35(44)32(41)27-24(37)17-21(3)26-28(27)29(33(35)42)31(40)22(4)30(26)39/h9,12,15,17,25,36-40,43-44H,7-8,10-11,13-14,16,18H2,1-6H3/b19-9+,20-15+,23-12-/t25-,35+/m1/s1

inchikey

  • YKKQCMZRKKBHMY-KVHDNOMISA-N

mass

  • 610.744

monoisotopicmass

  • 610.31418

smiles

  • O=C1C2=C(O)C(=C(O)C=3C2=C(C(O)=CC3C)C([C@@]1(O)C/C=C(/CC/C=C(/CC/C=C(/CO)/CC[C@@H](O)C(O)(C)C)/C)/C)=O)C

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[(2E,6E,10Z,14R)-14,15-dihydroxy-11-(hydroxymethyl)-3,7,15-trimethylhexadeca-2,6,10-trienyl]-2,4,6,9-tetrahydroxy-5,7-dimethylphenalene-1,3-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:208278

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