Chem
J-GLOBAL ID:200907084829205555   Nikkaji number:J524.475G

(5R)-5β-[4-Hydroxy-3,5-dimethoxyphenyl]-9α-(2,3-dihydroxypropoxy)-5,8,8aβ,9-tetrahydrofuro[3′,4′:6,7]naphtho[2,3-d]-1,3-dioxol-6(5aαH)-one

(5R)-5β-(3,5-ジメトキシ-4-ヒドロキシフェニル)-9α-(2,3-ジヒドロキシプロポキシ)-5,8,8aβ,9-テトラヒドロフロ[3′,4′:6,7]ナフト[2,3-d]-1,3-ジオキソール-6(5aαH)-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: C24H26O10
Molecular formula furigana: C24-H26-O10
Molecular weight: 474.462
InChI: InChI=1S/C24H26O10/c1-29-18-3-11(4-19(30-2)22(18)27)20-13-5-16-17(34-10-33-16)6-14(13)23(31-8-12(26)7-25)15-9-32-24(28)21(15)20/h3-6,12,15,20-21,23,25-27H,7-10H2,1-2H3/t12?,15-,20+,21-,23+/m0/s1
InChI key: LLMMWDVOLYABIF-LQNPLQFHSA-N
SMILES: COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](OCC(O)CO)c2cc3OCOc3cc12
Systematic name  (4):
  • (5R)-5β-(3,5-ジメトキシ-4-ヒドロキシフェニル)-9α-(2,3-ジヒドロキシプロポキシ)-5,8,8aβ,9-テトラヒドロフロ[3′,4′:6,7]ナフト[2,3-d]-1,3-ジオキソール-6(5aαH)-オン
  • (5R)-5β-[4-ヒドロキシ-3,5-ジメトキシフェニル]-9α-(2,3-ジヒドロキシプロポキシ)-5,8,8aβ,9-テトラヒドロフロ[3′,4′:6,7]ナフト[2,3-d]-1,3-ジオキソール-6(5aαH)-オン
  • (10R,11R,15R,16S)-16-(2,3-ジヒドロキシプロポキシ)-10-(4-ヒドロキシ-3,5-ジメトキシフェニル)-4,6,13-トリオキサテトラシクロ[7.7.0.03,7.011,15]ヘキサデカ-1,3(7),8-トリエン-12-オン
  • (10R,11R,15R,16S)-16-(2,3-dihydroxypropoxy)-10-(4-hydroxy-3,5-dimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.03,7.011,15]hexadeca-1,3(7),8-trien-12-one
Other name (1):
  • (5R)-5β-[4-Hydroxy-3,5-dimethoxyphenyl]-9α-(2,3-dihydroxypropoxy)-5,8,8aβ,9-tetrahydrofuro[3′,4′:6,7]naphtho[2,3-d]-1,3-dioxol-6(5aαH)-one
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