Chem
J-GLOBAL ID:200907026564914966   Nikkaji number:J2.325.040C

(3R)-4β-(Benzyloxy)-3β-hydroxy-3,4,4aβ,11bβ-tetrahydro-6H-[1,3]benzodioxolo[5,6-c][1]benzopyran-6-one

(3R)-4β-(ベンジルオキシ)-3β-ヒドロキシ-3,4,4aβ,11bβ-テトラヒドロ-6H-[1,3]ベンゾジオキソロ[5,6-c][1]ベンゾピラン-6-オン
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: C21H18O6
Molecular formula furigana: C21-H18-O6
Molecular weight: 366.369
InChI: InChI=1S/C21H18O6/c22-16-7-6-13-14-8-17-18(26-11-25-17)9-15(14)21(23)27-19(13)20(16)24-10-12-4-2-1-3-5-12/h1-9,13,16,19-20,22H,10-11H2/t13-,16+,19+,20+/m0/s1
InChI key: PRVMNSAWYWEPLB-GSJUVLCZSA-N
SMILES: O[C@@H]1C=C[C@@H]2[C@@H](OC(=O)c3cc4OCOc4cc23)[C@@H]1OCc1ccccc1
Systematic name  (3):
  • (3R)-4β-(ベンジルオキシ)-3β-ヒドロキシ-3,4,4aβ,11bβ-テトラヒドロ-6H-[1,3]ベンゾジオキソロ[5,6-c][1]ベンゾピラン-6-オン
  • (2S,5R,6R,7R)-6-(ベンジルオキシ)-5-ヒドロキシ-8,13,15-トリオキサテトラシクロ[8.7.0.02,7.012,16]ヘプタデカ-1(17),3,10,12(16)-テトラエン-9-オン
  • (2S,5R,6R,7R)-6-(benzyloxy)-5-hydroxy-8,13,15-trioxatetracyclo[8.7.0.02,7.012,16]heptadeca-1(17),3,10,12(16)-tetraen-9-one
Other name (1):
  • (3R)-4β-(Benzyloxy)-3β-hydroxy-3,4,4aβ,11bβ-tetrahydro-6H-[1,3]benzodioxolo[5,6-c][1]benzopyran-6-one
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