Chem
J-GLOBAL ID：201007042949673060   Nikkaji number：J2.777.649C

Gibberellin A8-catabolite

ジゲレリンA8-カタボライト
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： C19H22O7
Molecular formula furigana： C19-H22-O7
Molecular weight： 362.378
InChI： InChI=1S/C19H22O7/c1-8-6-18-7-19(8,26)4-3-10(18)9-5-11(20)14(21)17(2,16(24)25)12(9)13(18)15(22)23/h5,10,12-14,21,26H,1,3-4,6-7H2,2H3,(H,22,23)(H,24,25)/t10-,12+,13+,14-,17-,18-,19-/m0/s1
InChI key： NAOFYNMJUGRAFS-UWSJOQIXSA-N
SMILES： C[C@@]1([C@H]2[C@H](C(=O)O)[C@@]34CC(=C)[C@@](O)(C3)CC[C@H]4C2=CC(=O)[C@@H]1O)C(=O)O
Systematic name  (3)：
  • 2β,7-ジヒドロキシ-1-メチル-8-メチレン-3-オキソギバ-4-エン-1α,10β-ジカルボン酸
  • (1S,2S,3S,4S,5R,9R,12S)-5,12-ジヒドロキシ-4-メチル-13-メチリデン-6-オキソテトラシクロ[10.2.1.01,9.03,8]ペンタデカ-7-エン-2,4-ジカルボン酸
  • (1S,2S,3S,4S,5R,9R,12S)-5,12-dihydroxy-4-methyl-13-methylidene-6-oxotetracyclo[10.2.1.01,9.03,8]pentadec-7-ene-2,4-dicarboxylic acid
Other name (3)：
  • 2β,7-Dihydroxy-1-methyl-8-methylene-3-oxogibba-4-ene-1α,10β-dicarboxylic acid
  • Gibberellin A8-catabolite
  • ジゲレリンA8-カタボライト
CAS registry number： 78791-79-4
KEGG COMPOUND： C11870
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