Chem
J-GLOBAL ID：200907094527747800
Nikkaji number：J2.391.003I
Floralginsenoside K
フローラルギンセノシドK
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
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
Molecular formula： C50H84O21
Molecular formula furigana： C50-H84-O21
Molecular weight： 1021.201
InChI：
InChI=1S/C50H84O21/c1-22(2)26(71-63)11-17-50(9,70-44-41(62)37(58)34(55)27(19-51)65-44)24-10-15-49(8)33(24)25(54)18-31-47(6)14-13-32(46(4,5)30(47)12-16-48(31,49)7)68-45-42(39(60)35(56)28(20-52)66-45)69-43-40(61)38(59)36(57)29(67-43)21-64-23(3)53/h24-45,51-52,54-63H,1,10-21H2,2-9H3/t24-,25+,26?,27+,28+,29+,30-,31+,32-,33-,34+,35+,36+,37-,38-,39-,40+,41+,42+,43-,44-,45-,47-,48+,49+,50-/m0/s1
InChI key：
RSDKNHWOXVSQLB-HMAXXWIGSA-N
SMILES：
CC(=O)OC[C@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2O[C@H]2CC[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3C[C@@H](O)[C@@H]3[C@H](CC[C@@]43C)[C@](C)(CCC(OO)C(=C)C)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name (4)：
- (20S)-3β-[2-O-(6-O-アセチル-β-D-グルコピラノシル)-β-D-グルコピラノシルオキシ]-20-(β-D-グルコピラノシルオキシ)-24-ヒドロペルオキシダンマラ-25-エン-12β-オール
- 3β-[2-O-(6-O-アセチル-β-D-グルコピラノシル)-β-D-グルコピラノシルオキシ]-20-(β-D-グルコピラノシルオキシ)-24-ヒドロペルオキシダンマラ-25-エン-12β-オール
- [(2R,3S,4S,5R,6S)-6-{[(2R,3R,4S,5S,6R)-2-{[(1S,3aR,3bR,5aR,7S,9aR,9bR,11R,11aR)-1-[(2S)-5-ヒドロペルオキシ-6-メチル-2-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}ヘプタ-6-エン-2-イル]-11-ヒドロキシ-3a,3b,6,6,9a-ペンタメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-7-イル]オキシ}-4,5-ジヒドロキシ-6-(ヒドロキシメチル)オキサン-3-イル]オキシ}-3,4,5-トリヒドロキシオキサン-2-イル]メチル アセタート
- [(2R,3S,4S,5R,6S)-6-{[(2R,3R,4S,5S,6R)-2-{[(1S,3aR,3bR,5aR,7S,9aR,9bR,11R,11aR)-1-[(2S)-5-hydroperoxy-6-methyl-2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hept-6-en-2-yl]-11-hydroxy-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate
- (20S)-3β-[2-O-(6-O-Acetyl-β-D-glucopyranosyl)-β-D-glucopyranosyloxy]-20-(β-D-glucopyranosyloxy)-24-hydroperoxydammara-25-ene-12β-ol
- フローラルギンセノシドK
- Floralginsenoside K
- 3β-[2-O-(6-O-Acetyl-β-D-glucopyranosyl)-β-D-glucopyranosyloxy]-20-(β-D-glucopyranosyloxy)-24-hydroperoxydammara-25-ene-12β-ol
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