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Concept information

Preferred term

تریکوبیسورتینول B  

Type

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

charge

  • 0

formula

  • C28H36O9

inchi

  • InChI=1S/C28H36O9/c1-6-7-9-12-18(30)17-15-25(3,35)28(36)26(4,24(17)34)22-20(19(31)13-10-8-11-14-29)21(32)16(2)23(33)27(22,5)37-28/h6-8,10-11,13,17,22,29,31-32,35-36H,9,12,14-15H2,1-5H3/t17?,22-,25+,26-,27+,28+/m1/s1

inchikey

  • CANLDOWAUDIZEB-YKUKNFLJSA-N

mass

  • 516.587

monoisotopicmass

  • 516.23593

smiles

  • O=C1C(=C(O)C(=C(O)C=CC=CCO)[C@H]2[C@@]1(O[C@@]3(O)[C@@](O)(CC(C([C@@]23C)=O)C(=O)CCC=CC)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (4S,4aR,5aS,9aR,9bR)-9-(1,6-dihydroxyhexa-2,4-dienylidene)-2-hex-4-enoyl-4,4a,8-trihydroxy-4,5a,7,9b-tetramethyl-3,9a-dihydro-2H-dibenzouran-1,6-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:223374

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