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Concept information

Preferred term

bipolarin e  

Type

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

Broader concept

charge

  • 0

formula

  • C25H36O4

inchi

  • InChI=1S/C25H36O4/c1-15(13-26)9-19-11-17(3)25(29-19)8-7-24(4)12-20-16(2)10-21(28)23(20)18(14-27)5-6-22(24)25/h5,9,16-17,19,22,26-27H,6-8,10-14H2,1-4H3/b15-9+,18-5-/t16-,17+,19+,22-,24-,25+/m1/s1

inchikey

  • WXYLJWPCXKPYHP-FVCZJGEXSA-N

mass

  • 400.559

monoisotopicmass

  • 400.26136

smiles

  • O=C1C=2C(=CC[C@H]3[C@]4(O[C@@H](/C=C(/CO)/C)C[C@@H]4C)CC[C@@]3(CC2[C@@H](C1)C)C)CO

subset

  • 2_STAR

synonym EXACT

  • (1'R,2S,3S,4'R,5R,8'E,11'R)-8'-(hydroxymethyl)-5-[(E)-3-hydroxy-2-methylprop-1-enyl]-1',3,4'-trimethylspiro[oxolane-2,12'-tricyclo[9.3.0.03,7]tetradeca-3(7),8-diene]-6'-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:212323

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