Chem
J-GLOBAL ID：200907032149611320   Nikkaji number：J10.224E

Tingenin B

チンゲニンB
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： C28H36O4
Molecular formula furigana： C28-H36-O4
Molecular weight： 436.592
InChI： InChI=1S/C28H36O4/c1-15-13-21-26(4,24(32)22(15)30)10-12-27(5)20-8-7-17-16(2)23(31)19(29)14-18(17)25(20,3)9-11-28(21,27)6/h7-8,14-15,21,24,31-32H,9-13H2,1-6H3/t15-,21-,24-,25+,26-,27-,28+/m1/s1
InChI key： QIRUFAFQGKOTKA-ZRWKYKNNSA-N
SMILES： C[C@@H]1C[C@@H]2[C@@](C)(CC[C@]3(C)C4=CC=C5C(=C(O)C(=O)C=C5[C@]4(C)CC[C@@]23C)C)[C@H](O)C1=O
Systematic name  (4)：
  • 3,22β-ジヒドロキシ-24,29-ジノル-D:A-フリードオレアナ-1(10),3,5,7-テトラエン-2,21-ジオン
  • 3,22β-ジヒドロキシ-24,29-ジノルフリーデラ-1(10),3,5,7-テトラエン-2,21-ジオン
  • (6bS,8aR,9S,11R,12aS,12bS,14aR)-3,9-ジヒドロキシ-4,6b,8a,11,12b,14a-ヘキサメチル-2,6b,7,8,8a,9,10,11,12,12a,12b,13,14,14a-テトラデカヒドロピセン-2,10-ジオン
  • (6bS,8aR,9S,11R,12aS,12bS,14aR)-3,9-dihydroxy-4,6b,8a,11,12b,14a-hexamethyl-2,6b,7,8,8a,9,10,11,12,12a,12b,13,14,14a-tetradecahydropicene-2,10-dione
Other name (8)：
  • チンゲニンB
  • Tingenin B
  • 3,22β-Dihydroxy-24,29-dinor-D:A-friedoolean-1(10),3,5,7-tetrene-2,21-dione
  • 22β-ヒドロキシチンゲノン
  • 22β-Hydroxytingenone
Show all
CAS registry number： 50656-68-3
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