Chem
J-GLOBAL ID：200907081990643776   Nikkaji number：J468.927E

(Z)-3,7,11-Trimethyl-3-[[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-[[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： C33H56O14
Molecular formula furigana： C33-H56-O14
Molecular weight： 676.797
InChI： InChI=1S/C33H56O14/c1-8-33(7,14-10-13-17(4)12-9-11-16(2)3)47-32-29(24(38)22(36)20(15-34)44-32)46-31-27(41)25(39)28(19(6)43-31)45-30-26(40)23(37)21(35)18(5)42-30/h8,11,13,18-32,34-41H,1,9-10,12,14-15H2,2-7H3/b17-13-/t18-,19-,20+,21-,22+,23+,24-,25-,26+,27+,28-,29+,30-,31-,32-,33?/m0/s1
InChI key： NLQYAUOYHNMEPR-HTZFOUBCSA-N
SMILES： C[C@@H]1O[C@@H](O[C@H]2[C@H](C)O[C@@H](O[C@@H]3[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]3OC(C)(CC/C=C(/C)\CCC=C(C)C)C=C)[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-[[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
  • (2S,3R,4R,5R,6S)-2-{[(2S,3R,4S,5R,6S)-6-{[(2S,3R,4S,5S,6R)-4,5-ジヒドロキシ-6-(ヒドロキシメチル)-2-{[(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-3-イル]オキシ}-4,5-ジヒドロキシ-2-メチルオキサン-3-イル]オキシ}-6-メチルオキサン-3,4,5-トリオール
  • (2S,3R,4R,5R,6S)-2-{[(2S,3R,4S,5R,6S)-6-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(6Z)-3,7,11-trimethyldodeca-1,6,10-trien-3-yl]oxy}oxan-3-yl]oxy}-4,5-dihydroxy-2-methyloxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
Other name (1)：
  • (Z)-3,7,11-Trimethyl-3-[[2-O-(4-O-α-L-rhamnopyranosyl-α-L-rhamnopyranosyl)-β-D-glucopyranosyl]oxy]-1,6,10-dodecatriene
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