Chem
J-GLOBAL ID:200907029540858231
Nikkaji number:J2.669.011K
1-O,4-[(4-Deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)]-6-[2-(4-O-β-D-galactopyranosyl-L-gluconoylamino)ethylthio]-4,6-dideoxy-α-D-glucopyranose
1-O,4-[(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)]-6-[2-(4-O-β-D-ガラクトピラノシル-L-グルコノイルアミノ)エチルチオ]-4,6-ジデオキシ-α-D-グルコピラノース
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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:
C56 H95 NO45 S
Molecular formula furigana:
C56-H95-N-O45-S
Molecular weight:
1534.400
InChI:
InChI=1S/C56H95NO45S/c58-3-12(66)40(95-49-32(78)22(68)21(67)13(4-59)87-49)23(69)31(77)48(86)57-1-2-103-11-20-47-30(76)39(85)56(94-20)101-46-19(10-65)92-54(37(83)28(46)74)99-44-17(8-63)90-52(35(81)26(44)72)97-42-15(6-61)88-50(33(79)24(42)70)96-41-14(5-60)89-51(34(80)25(41)71)98-43-16(7-62)91-53(36(82)27(43)73)100-45-18(9-64)93-55(102-47)38(84)29(45)75/h12-47,49-56,58-85H,1-11H2,(H,57,86)
InChI key:
FSOSNHLGYFYYHU-UHFFFAOYSA-N
SMILES:
OCC(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)C(=O)NCCSCC1OC2OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(OC8C(CO)OC(OC1C(O)C2O)C(O)C8O)C(O)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O
Systematic name (3):
1-O,4-[(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)(4-デオキシ-α-D-グルコピラノース-4,1-O-ジイル)]-6-[2-(4-O-β-D-ガラクトピラノシル-L-グルコノイルアミノ)エチルチオ]-4,6-ジデオキシ-α-D-グルコピラノース
2,3,5,6-テトラヒドロキシ-N-[2-({[36,37,38,39,40,41,42,43,44,45,46,47,48,49-テトラデカヒドロキシ-10,15,20,25,30,35-ヘキサキス(ヒドロキシメチル)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-テトラデカオキサオクタシクロ[31.2.2.23,6 .28,11 .213,16 .218,21 .223,26 .228,31 ]ノナテトラコンタン-5-イル]メチル}スルファニル)エチル]-4-{[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}ヘキサンアミド
2,3,5,6-tetrahydroxy-N-[2-({[36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecahydroxy-10,15,20,25,30,35-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6 .28,11 .213,16 .218,21 .223,26 .228,31 ]nonatetracontan-5-yl]methyl}sulfanyl)ethyl]-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanamide
Other name (1):
1-O,4-[(4-Deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)(4-deoxy-α-D-glucopyranose-4,1-O-diyl)]-6-[2-(4-O-β-D-galactopyranosyl-L-gluconoylamino)ethylthio]-4,6-dideoxy-α-D-glucopyranose
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