Chem
J-GLOBAL ID：200907000035749705   Nikkaji number：J445.275E

Germacranolide

ゲルマクラノリド
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： C15H22O4
Molecular formula furigana： C15-H22-O4
Molecular weight： 266.337
InChI： InChI=1S/C15H22O4/c1-8-4-5-11(16)9(2)7-12(17)14-10(3)15(18)19-13(14)6-8/h6-7,10-14,16-17H,4-5H2,1-3H3/b8-6+,9-7-/t10-,11-,12-,13+,14+/m0/s1
InChI key： XTPXQIMSDYOFGC-WMPWNNBPSA-N
SMILES： C[C@H]1[C@H]2[C@H](OC1=O)/C=C(\C)/CC[C@H](O)/C(=C\[C@@H]2O)/C
Systematic name  (3)：
  • (3aR,5Z,10E)-3aβ,4,7,8,9,11aα-ヘキサヒドロ-4β,7β-ジヒドロキシ-3β,6,10-トリメチルシクロデカ[b]フラン-2(3H)-オン
  • (3S,3aR,4S,7S,11aR)-4,7-ジヒドロキシ-3,6,10-トリメチル-2H,3H,3aH,4H,7H,8H,9H,11aH-シクロデカ[b]フラン-2-オン
  • (3S,3aR,4S,7S,11aR)-4,7-dihydroxy-3,6,10-trimethyl-2H,3H,3aH,4H,7H,8H,9H,11aH-cyclodeca[b]furan-2-one
Other name (3)：
  • ゲルマクラノリド
  • Germacranolide
  • (3aR,5Z,10E)-3aβ,4,7,8,9,11aα-Hexahydro-4β,7β-dihydroxy-3β,6,10-trimethylcyclodeca[b]furan-2(3H)-one
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