Chem
J-GLOBAL ID：200907070667328916   Nikkaji number：J933.886A

Triptocalline A

トリプトカリンA
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： C28H42O4
Molecular formula furigana： C28-H42-O4
Molecular weight： 442.640
InChI： InChI=1S/C28H42O4/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/h15,18-21,24,29,32H,7-14H2,1-6H3/t15-,18-,19+,20+,21-,24-,25-,26-,27-,28+/m1/s1
InChI key： UUGCGHAFZPEHIC-YNPPZOCPSA-N
SMILES： C[C@@H]1C[C@@H]2[C@@](C)(CC[C@]3(C)[C@H]4CCC5=C(C)C(=O)[C@@H](O)C[C@H]5[C@@]4(C)CC[C@@]23C)[C@H](O)C1=O
Systematic name  (3)：
  • 2β,22β-ジヒドロキシ-24,29-ジノルフリーデラ-4-エン-3,21-ジオン
  • (2R,4S,4aR,6aR,6bS,11S,12aS,12bR,14aS,14bS)-4,11-ジヒドロキシ-2,4a,6a,9,12b,14a-ヘキサメチル-1,2,3,4,4a,5,6,6a,6b,7,8,10,11,12,12a,12b,13,14,14a,14b-イコサヒドロピセン-3,10-ジオン
  • (2R,4S,4aR,6aR,6bS,11S,12aS,12bR,14aS,14bS)-4,11-dihydroxy-2,4a,6a,9,12b,14a-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,10,11,12,12a,12b,13,14,14a,14b-icosahydropicene-3,10-dione
Other name (3)：
  • トリプトカリンA
  • Triptocalline A
  • 2β,22β-Dihydroxy-24,29-dinorfriedel-4-ene-3,21-dione
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