Chem
J-GLOBAL ID：200907002497435318   Nikkaji number：J989.526D

Isoampelopsin F

イソアンペロプシンF
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C28H22O6
Molecular formula furigana： C28-H22-O6
Molecular weight： 454.478
InChI： InChI=1S/C28H22O6/c29-15-5-1-13(2-6-15)23-25-19(9-17(31)11-21(25)33)28-24(14-3-7-16(30)8-4-14)27(23)20-10-18(32)12-22(34)26(20)28/h1-12,23-24,27-34H/t23-,24-,27-,28+/m1/s1
InChI key： LJHNYAXAPRDORG-CDORBJOZSA-N
SMILES： Oc1ccc(cc1)[C@@H]1[C@H]2[C@H](c3ccc(O)cc3)c3c(O)cc(O)cc3[C@@H]1c1c2cc(O)cc1O
Systematic name  (3)：
  • (5R,10S,11R,12R)-10,11-ジヒドロ-11,12-ビス(4-ヒドロキシフェニル)-5,10-メタノ-5H-ジベンゾ[a,d]シクロヘプテン-1,3,6,8-テトラオール
  • (1R,8R,9S,16R)-8,16-ビス(4-ヒドロキシフェニル)テトラシクロ[7.6.1.02,7.010,15]ヘキサデカ-2,4,6,10(15),11,13-ヘキサエン-4,6,12,14-テトラオール
  • (1R,8R,9S,16R)-8,16-bis(4-hydroxyphenyl)tetracyclo[7.6.1.02,7.010,15]hexadeca-2,4,6,10(15),11,13-hexaene-4,6,12,14-tetrol
Other name (3)：
  • (5R,10S,11R,12R)-10,11-Dihydro-11,12-bis(4-hydroxyphenyl)-5,10-methano-5H-dibenzo[a,d]cycloheptene-1,3,6,8-tetrol
  • イソアンペロプシンF
  • Isoampelopsin F
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