Chem
J-GLOBAL ID：200907023974218593
Nikkaji number：J842.642B
Notoginsenoside G
ノトギンセノシドG
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： C48H80O19
Molecular formula furigana： C48-H80-O19
Molecular weight： 961.149
InChI：
InChI=1S/C48H80O19/c1-21(2)10-9-13-47(7,67-42-39(61)36(58)33(55)25(19-50)63-42)22-11-15-46(6)31(22)23(52)16-28-45(5)14-12-30(44(3,4)27(45)17-29(53)48(28,46)8)65-43-40(37(59)34(56)26(20-51)64-43)66-41-38(60)35(57)32(54)24(18-49)62-41/h10,17,22-26,28-43,49-61H,9,11-16,18-20H2,1-8H3/t22-,23+,24+,25+,26+,28+,29-,30-,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43-,45-,46+,47-,48-/m0/s1
InChI key：
BJTRHGSEMPBIPZ-XZNKTVAQSA-N
SMILES：
CC(=CCC[C@](C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C(C)(C)C3=C[C@H](O)[C@@]21C)C
Systematic name (4)：
- 3β-(2-O-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)ダンマラ-5,24-ジエン-7β,12β-ジオール
- (20S)-3β-(2-O-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)ダンマラ-5,24-ジエン-7β,12β-ジオール
- (2S,3R,4S,5S,6R)-2-{[(2S)-2-[(1S,3aR,3bR,4S,7S,9aR,9bR,11R,11aR)-7-{[(2R,3R,4S,5S,6R)-4,5-ジヒドロキシ-6-(ヒドロキシメチル)-3-{[(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}オキサン-2-イル]オキシ}-4,11-ジヒドロキシ-3a,3b,6,6,9a-ペンタメチル-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-1-イル]-6-メチルヘプタ-5-エン-2-イル]オキシ}-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
- (2S,3R,4S,5S,6R)-2-{[(2S)-2-[(1S,3aR,3bR,4S,7S,9aR,9bR,11R,11aR)-7-{[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4,11-dihydroxy-3a,3b,6,6,9a-pentamethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-6-methylhept-5-en-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
- ノトギンセノシドG
- Notoginsenoside G
- 3β-(2-O-β-D-Glucopyranosyl-β-D-glucopyranosyloxy)-20-(β-D-glucopyranosyloxy)dammara-5,24-diene-7β,12β-diol
- (20S)-3β-(2-O-β-D-Glucopyranosyl-β-D-glucopyranosyloxy)-20-(β-D-glucopyranosyloxy)dammara-5,24-diene-7β,12β-diol
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