Chem
J-GLOBAL ID：200907091938410831   Nikkaji number：J1.939.129I

4-O-[4-O-[4-O-[4-O-[4-O-(α-D-Galactopyranuronosyl)-α-D-galactopyranuronosyl]-6-O-methyl-α-D-galactopyranuronosyl]-6-O-methyl-α-D-galactopyranuronosyl]-6-O-methyl-α-D-galactopyranuronosyl]-D-galactopyranuronic acid

4-O-[4-O-[4-O-[4-O-[4-O-(α-D-ガラクトピラヌロノシル)-α-D-ガラクトピラヌロノシル]-6-O-メチル-α-D-ガラクトピラヌロノシル]-6-O-メチル-α-D-ガラクトピラヌロノシル]-6-O-メチル-α-D-ガラクトピラヌロノシル]-D-ガラクトピラヌロン酸
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： C39H56O37
Molecular formula furigana： C39-H56-O37
Molecular weight： 1116.840
InChI： InChI=1S/C39H56O37/c1-63-32(60)25-19(69-36-13(49)7(43)18(24(73-36)30(57)58)68-35-12(48)4(40)5(41)22(72-35)28(53)54)9(45)15(51)38(75-25)71-21-10(46)16(52)39(76-27(21)34(62)65-3)70-20-8(44)14(50)37(74-26(20)33(61)64-2)67-17-6(42)11(47)31(59)66-23(17)29(55)56/h4-27,31,35-52,59H,1-3H3,(H,53,54)(H,55,56)(H,57,58)/t4-,5+,6+,7+,8+,9+,10+,11+,12+,13+,14+,15+,16+,17+,18+,19+,20+,21+,22-,23-,24-,25-,26-,27-,31?,35-,36-,37-,38-,39-/m0/s1
InChI key： TZQUWOVYIWYYRC-JNKYKCKVSA-N
SMILES： COC(=O)[C@H]1O[C@H](O[C@@H]2[C@H](O)[C@@H](O)C(O)O[C@@H]2C(=O)O)[C@H](O)[C@@H](O)[C@H]1O[C@H]1O[C@@H]([C@H](O[C@H]2O[C@@H]([C@H](O[C@H]3O[C@@H]([C@H](O[C@H]4O[C@@H]([C@H](O)[C@H](O)[C@H]4O)C(=O)O)[C@H](O)[C@H]3O)C(=O)O)[C@H](O)[C@H]2O)C(=O)OC)[C@H](O)[C@H]1O)C(=O)OC
Systematic name  (4)：
  • 4-O-[4-O-[4-O-[4-O-[4-O-(α-D-ガラクトピラヌロノシル)-α-D-ガラクトピラヌロノシル]-6-O-メチル-α-D-ガラクトピラヌロノシル]-6-O-メチル-α-D-ガラクトピラヌロノシル]-6-O-メチル-α-D-ガラクトピラヌロノシル]-D-ガラクトピラヌロン酸
  • 4-O-[4-O-[4-O-[4-O-[4-O-(6-オキソ-α-D-ガラクトピラノシル)-6-オキソ-α-D-ガラクトピラノシル]-6-オキソ-6-O-メチル-α-D-ガラクトピラノシル]-6-オキソ-6-O-メチル-α-D-ガラクトピラノシル]-6-オキソ-6-O-メチル-α-D-ガラクトピラノシル]-D-ガラクトピラヌロン酸
  • (2S,3R,4R,5R)-3-{[(2S,3R,4R,5R,6S)-5-{[(2S,3R,4R,5R,6S)-5-{[(2S,3R,4R,5R,6S)-5-{[(2S,3R,4R,5R,6S)-6-カルボキシ-5-{[(2S,3R,4S,5R,6S)-6-カルボキシ-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}-3,4-ジヒドロキシオキサン-2-イル]オキシ}-3,4-ジヒドロキシ-6-(メトキシカルボニル)オキサン-2-イル]オキシ}-3,4-ジヒドロキシ-6-(メトキシカルボニル)オキサン-2-イル]オキシ}-3,4-ジヒドロキシ-6-(メトキシカルボニル)オキサン-2-イル]オキシ}-4,5,6-トリヒドロキシオキサン-2-カルボン酸
  • (2S,3R,4R,5R)-3-{[(2S,3R,4R,5R,6S)-5-{[(2S,3R,4R,5R,6S)-5-{[(2S,3R,4R,5R,6S)-5-{[(2S,3R,4R,5R,6S)-6-carboxy-5-{[(2S,3R,4S,5R,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4-dihydroxyoxan-2-yl]oxy}-3,4-dihydroxy-6-(methoxycarbonyl)oxan-2-yl]oxy}-3,4-dihydroxy-6-(methoxycarbonyl)oxan-2-yl]oxy}-3,4-dihydroxy-6-(methoxycarbonyl)oxan-2-yl]oxy}-4,5,6-trihydroxyoxane-2-carboxylic acid
Other name (2)：
  • 4-O-[4-O-[4-O-[4-O-[4-O-(α-D-Galactopyranuronosyl)-α-D-galactopyranuronosyl]-6-O-methyl-α-D-galactopyranuronosyl]-6-O-methyl-α-D-galactopyranuronosyl]-6-O-methyl-α-D-galactopyranuronosyl]-D-galactopyranuronic acid
  • 4-O-[4-O-[4-O-[4-O-[4-O-(6-Oxo-α-D-galactopyranosyl)-6-oxo-α-D-galactopyranosyl]-6-oxo-6-O-methyl-α-D-galactopyranosyl]-6-oxo-6-O-methyl-α-D-galactopyranosyl]-6-oxo-6-O-methyl-α-D-galactopyranosyl]-D-galactopyranuronic acid
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