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Concept information

Preferred term

copalliferol b  

Type

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

Broader concept

charge

  • 0

formula

  • C42H32O9

inchi

  • InChI=1S/C42H32O9/c43-24-7-1-20(2-8-24)35-38(23-13-27(46)15-28(47)14-23)36(21-3-9-25(44)10-4-21)41-32-17-30(49)19-34(51)40(32)37(22-5-11-26(45)12-6-22)42(41)31-16-29(48)18-33(50)39(31)35/h1-19,35,37,41-51H/t35-,37+,41-,42+/m0/s1

inchikey

  • WJBCPQVBWGTJNA-GUOLYAGMSA-N

mass

  • 680.700

monoisotopicmass

  • 680.20463

smiles

  • Oc1ccc(cc1)[C@H]1[C@@H]2[C@@H](c3cc(O)cc(O)c13)C(c1ccc(O)cc1)=C([C@H](c1ccc(O)cc1)c1c(O)cc(O)cc21)c1cc(O)cc(O)c1

subset

  • 2_STAR

synonym EXACT

  • Copalliferol B

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:3872

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