Chem
J-GLOBAL ID:200907022353876701
Nikkaji number:J524.480C
4α,6,7-Trihydroxy-9β-[4-hydroxy-3,5-dimethoxyphenyl]-3aβ,4,9,9aα-tetrahydronaphtho[2,3-c]furan-1(3H)-one
4α,6,7-トリヒドロキシ-9β-[4-ヒドロキシ-3,5-ジメトキシフェニル]-3aβ,4,9,9aα-テトラヒドロナフト[2,3-c]フラン-1(3H)-オン
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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:
C20 H20 O8
Molecular formula furigana:
C20-H20-O8
Molecular weight:
388.372
InChI:
InChI=1S/C20H20O8/c1-26-14-3-8(4-15(27-2)19(14)24)16-9-5-12(21)13(22)6-10(9)18(23)11-7-28-20(25)17(11)16/h3-6,11,16-18,21-24H,7H2,1-2H3/t11-,16+,17-,18+/m0/s1
InChI key:
SMPCOLOECPREKW-HQKIHSOMSA-N
SMILES:
COc1cc(cc(OC)c1O)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](O)c2cc(O)c(O)cc12
Systematic name (3):
4α,6,7-トリヒドロキシ-9β-[4-ヒドロキシ-3,5-ジメトキシフェニル]-3aβ,4,9,9aα-テトラヒドロナフト[2,3-c]フラン-1(3H)-オン
(3aR,4S,9R,9aR)-4,6,7-トリヒドロキシ-9-(4-ヒドロキシ-3,5-ジメトキシフェニル)-1H,3H,3aH,4H,9H,9aH-ナフト[2,3-c]フラン-1-オン
(3aR,4S,9R,9aR)-4,6,7-trihydroxy-9-(4-hydroxy-3,5-dimethoxyphenyl)-1H,3H,3aH,4H,9H,9aH-naphtho[2,3-c]furan-1-one
Other name (1):
4α,6,7-Trihydroxy-9β-[4-hydroxy-3,5-dimethoxyphenyl]-3aβ,4,9,9aα-tetrahydronaphtho[2,3-c]furan-1(3H)-one
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