Chem
J-GLOBAL ID：200907077618185292   Nikkaji number：J468.926G

(Z)-3,7,11-Trimethyl-3-[[6-O-α-L-rhamnopyranosyl-2-O-(4-O-α-L-rhamnopyranosyl-α-L-rhamnopyranosyl)-β-D-glucopyranosyl]oxy]-1,6,10-dodecatriene

(Z)-3,7,11-トリメチル-3-[[6-O-α-L-ラムノピラノシル-2-O-(4-O-α-L-ラムノピラノシル-α-L-ラムノピラノシル)-β-D-グルコピラノシル]オキシ]-1,6,10-ドデカトリエン
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： C39H66O18
Molecular formula furigana： C39-H66-O18
Molecular weight： 822.939
InChI： InChI=1S/C39H66O18/c1-9-39(8,15-11-14-18(4)13-10-12-17(2)3)57-38-34(28(45)25(42)22(54-38)16-50-35-30(47)26(43)23(40)19(5)51-35)56-37-32(49)29(46)33(21(7)53-37)55-36-31(48)27(44)24(41)20(6)52-36/h9,12,14,19-38,40-49H,1,10-11,13,15-16H2,2-8H3/b18-14-/t19-,20-,21-,22+,23-,24-,25+,26+,27+,28-,29-,30+,31+,32+,33-,34+,35+,36-,37-,38-,39?/m0/s1
InChI key： RTDSIIMUYUALQO-ZEKYDTLHSA-N
SMILES： C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC(C)(CC/C=C(/C)\CCC=C(C)C)C=C)[C@H](O[C@@H]3O[C@@H](C)[C@H](O[C@@H]4O[C@@H](C)[C@H](O)[C@@H](O)[C@H]4O)[C@@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • (Z)-3,7,11-トリメチル-3-[[6-O-α-L-ラムノピラノシル-2-O-(4-O-α-L-ラムノピラノシル-α-L-ラムノピラノシル)-β-D-グルコピラノシル]オキシ]-1,6,10-ドデカトリエン
  • (2R,3R,4R,5R,6S)-2-{[(2R,3S,4S,5R,6S)-5-{[(2S,3R,4S,5R,6S)-3,4-ジヒドロキシ-6-メチル-5-{[(2S,3R,4R,5R,6S)-3,4,5-トリヒドロキシ-6-メチルオキサン-2-イル]オキシ}オキサン-2-イル]オキシ}-3,4-ジヒドロキシ-6-{[(6Z)-3,7,11-トリメチルドデカ-1,6,10-トリエン-3-イル]オキシ}オキサン-2-イル]メトキシ}-6-メチルオキサン-3,4,5-トリオール
  • (2R,3R,4R,5R,6S)-2-{[(2R,3S,4S,5R,6S)-5-{[(2S,3R,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-3,4-dihydroxy-6-{[(6Z)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl]oxy}oxan-2-yl]methoxy}-6-methyloxane-3,4,5-triol
Other name (1)：
  • (Z)-3,7,11-Trimethyl-3-[[6-O-α-L-rhamnopyranosyl-2-O-(4-O-α-L-rhamnopyranosyl-α-L-rhamnopyranosyl)-β-D-glucopyranosyl]oxy]-1,6,10-dodecatriene
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