Chem
J-GLOBAL ID:200907085453462787
Nikkaji number:J1.849.046C
2-(β-D-Galactopyranosyloxy)-3-(4-nitrophenoxy)propyl 3-O,4-O-isopropylidene-α-L-fucopyranoside
2-(β-D-ガラクトピラノシルオキシ)-3-(4-ニトロフェノキシ)プロピル3-O,4-O-イソプロピリデン-α-L-フコピラノシド
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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:
C24 H35 [N+]O13 [O-]
Molecular formula furigana:
C24-H35-N-O14
Molecular weight:
561.537
InChI:
InChI=1S/C24H35NO14/c1-11-20-21(39-24(2,3)38-20)19(30)22(35-11)34-10-14(9-33-13-6-4-12(5-7-13)25(31)32)36-23-18(29)17(28)16(27)15(8-26)37-23/h4-7,11,14-23,26-30H,8-10H2,1-3H3/t11-,14?,15+,16-,17-,18+,19-,20+,21-,22+,23+/m0/s1
InChI key:
ZKONTXYGKCGMHS-ASNHBSQWSA-N
SMILES:
C[C@@H]1O[C@@H](OCC(COc2ccc(cc2)[N+](=O)[O-])O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@@H]2OC(C)(C)O[C@H]12
Systematic name (3):
2-(β-D-ガラクトピラノシルオキシ)-3-(4-ニトロフェノキシ)プロピル3-O,4-O-イソプロピリデン-α-L-フコピラノシド
(2R,3R,4S,5R,6R)-2-[(1-{[(3aR,4S,6R,7S,7aS)-7-ヒドロキシ-2,2,4-トリメチル-ヘキサヒドロ-[1,3]ジオキソロ[4,5-c]ピラン-6-イル]オキシ}-3-(4-ニトロフェノキシ)プロパン-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
(2R,3R,4S,5R,6R)-2-[(1-{[(3aR,4S,6R,7S,7aS)-7-hydroxy-2,2,4-trimethyl-hexahydro-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy}-3-(4-nitrophenoxy)propan-2-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1):
2-(β-D-Galactopyranosyloxy)-3-(4-nitrophenoxy)propyl 3-O,4-O-isopropylidene-α-L-fucopyranoside
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