Chem
J-GLOBAL ID：200907043179916968   Nikkaji number：J1.715.997F

Agallochin G

アガロキンG
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： C20H30O2
Molecular formula furigana： C20-H30-O2
Molecular weight： 302.458
InChI： InChI=1S/C20H30O2/c1-16(2)14-5-7-18-9-8-17(3,12-18)6-4-15(18)19(14)10-11-20(16,21)22-13-19/h8-9,14-15,21H,4-7,10-13H2,1-3H3/t14-,15-,17-,18+,19+,20-/m0/s1
InChI key： RRYTXWAMRRHHAA-UMBUOUCESA-N
SMILES： C[C@]12C[C@@]3(CC[C@H]4C(C)(C)[C@]5(O)CC[C@]4(CO5)[C@H]3CC1)C=C2
Systematic name  (3)：
  • 3,20-エポキシベイエラ-15-エン-3α-オール
  • (1S,2S,5R,8S,11R,13S)-5,12,12-トリメチル-14-オキサペンタシクロ[11.2.2.15,8.01,11.02,8]オクタデカ-6-エン-13-オール
  • (1S,2S,5R,8S,11R,13S)-5,12,12-trimethyl-14-oxapentacyclo[11.2.2.15,8.01,11.02,8]octadec-6-en-13-ol
Other name (3)：
  • 3,20-Epoxybeyera-15-ene-3α-ol
  • アガロキンG
  • Agallochin G
Thsaurus map：
Thesaurus Map

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