Chem
J-GLOBAL ID:200907097948059430   Nikkaji number:J82.296E

Deacetylnomilin

デアセチルノミリン
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: C26H32O8
Molecular formula furigana: C26-H32-O8
Molecular weight: 472.534
InChI: InChI=1S/C26H32O8/c1-22(2)15-10-17(28)25(5)14(24(15,4)16(27)11-18(29)33-22)6-8-23(3)19(13-7-9-31-12-13)32-21(30)20-26(23,25)34-20/h7,9,12,14-16,19-20,27H,6,8,10-11H2,1-5H3/t14-,15+,16?,19+,20-,23+,24-,25+,26-/m1/s1
InChI key: HWAJASVMTDEFJN-MKBHYRRPSA-N
SMILES: C[C@@]12CC[C@@H]3[C@]4(C)[C@@H](CC(=O)[C@@]3(C)[C@@]31O[C@@H]3C(=O)O[C@H]2c1ccoc1)C(C)(C)OC(=O)CC4O
Systematic name  (4):
  • 1-ヒドロキシ-1,2-ジヒドロオウバク酸3,4-ラクトン
  • 1-ヒドロキシ-1,2-ジヒドロオバクン酸ε-ラクトン
  • (1R,2R,4S,7S,8S,11R,12R,18R)-7-(フラン-3-イル)-13-ヒドロキシ-1,8,12,17,17-ペンタメチル-3,6,16-トリオキサペンタシクロ[9.9.0.02,4.02,8.012,18]イコサン-5,15,20-トリオン
  • (1R,2R,4S,7S,8S,11R,12R,18R)-7-(furan-3-yl)-13-hydroxy-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icosane-5,15,20-trione
Other name (6):
  • デアセチルノミリン
  • Deacetylnomilin
  • デスアセチルノミリン
  • Desacetylnomilin
  • 1-Hydroxy-1,2-dihydroobacunoic acid ε-lactone
Show all
CAS registry number: 3264-90-2
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