Chem
J-GLOBAL ID:200907018862275914   Nikkaji number:J2.761.056K

Gibberellin A44 diacid

(4bβ)-7-ヒドロキシ-4aα-(ヒドロキシメチル)-1-メチル-8-メチレンギバン-1α,10β-ジカルボン酸
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: C20H28O6
Molecular formula furigana: C20-H28-O6
Molecular weight: 364.438
InChI: InChI=1S/C20H28O6/c1-11-8-19-9-20(11,26)7-4-12(19)18(10-21)6-3-5-17(2,16(24)25)14(18)13(19)15(22)23/h12-14,21,26H,1,3-10H2,2H3,(H,22,23)(H,24,25)/t12-,13+,14+,17+,18+,19-,20-/m0/s1
InChI key: AXEUUXHMKSPQAI-YTJHIPEWSA-N
SMILES: C[C@]1(CCC[C@@]2(CO)[C@@H]3CC[C@]4(O)C[C@]3(CC4=C)[C@H]([C@H]12)C(=O)O)C(=O)O
Systematic name  (3):
  • (4bβ)-7-ヒドロキシ-4aα-(ヒドロキシメチル)-1-メチル-8-メチレンギバン-1α,10β-ジカルボン酸
  • (1S,2S,3S,4R,8R,9R,12S)-12-ヒドロキシ-8-(ヒドロキシメチル)-4-メチル-13-メチリデンテトラシクロ[10.2.1.01,9.03,8]ペンタデカン-2,4-ジカルボン酸
  • (1S,2S,3S,4R,8R,9R,12S)-12-hydroxy-8-(hydroxymethyl)-4-methyl-13-methylidenetetracyclo[10.2.1.01,9.03,8]pentadecane-2,4-dicarboxylic acid
Other name (3):
  • (4bβ)-7-Hydroxy-4aα-(hydroxymethyl)-1-methyl-8-methylenegibbane-1α,10β-dicarboxylic acid
  • Gibberellin A44 diacid
  • Gibberellin A44 open lactone
CAS registry number: 88373-65-3
KEGG COMPOUND: C06095
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