Chem
J-GLOBAL ID:200907028152752069
Nikkaji number:J2.112.553I
1-O-Methyl-2-O-(6-O-acetyl-3-O,4-O-dibenzyl-2-azido-2-deoxy-α-D-glucopyranosyl)-6-O,7-O-diacetyl-α-L-glycero-D-manno-heptopyranose
1-O-メチル-2-O-(6-O-アセチル-3-O,4-O-ジベンジル-2-アジド-2-デオキシ-α-D-グルコピラノシル)-6-O,7-O-ジアセチル-α-L-glycero-D-manno-ヘプトピラノース
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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:
C34 H43 N[N-][N+]O14
Molecular formula furigana:
C34-H43-N3-O14
Molecular weight:
717.725
InChI:
InChI=1S/C34H43N3O14/c1-19(38)44-17-24(48-21(3)40)29-27(41)28(42)32(34(43-4)50-29)51-33-26(36-37-35)31(47-16-23-13-9-6-10-14-23)30(25(49-33)18-45-20(2)39)46-15-22-11-7-5-8-12-22/h5-14,24-34,41-42H,15-18H2,1-4H3/t24-,25+,26+,27-,28-,29+,30+,31+,32-,33+,34+/m0/s1
InChI key:
OGDZERCDSYOIDM-LLXQBNPFSA-N
SMILES:
CO[C@@H]1O[C@H]([C@H](COC(=O)C)OC(=O)C)[C@@H](O)[C@H](O)[C@@H]1O[C@H]1O[C@H](COC(=O)C)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1N=[N+]=[N-]
Systematic name (3):
1-O-メチル-2-O-(6-O-アセチル-3-O,4-O-ジベンジル-2-アジド-2-デオキシ-α-D-グルコピラノシル)-6-O,7-O-ジアセチル-α-L-glycero-D-manno-ヘプトピラノース
(1S)-2-(アセチルオキシ)-1-[(2S,3S,4S,5S,6R)-5-{[(2R,3R,4R,5S,6R)-6-[(アセチルオキシ)メチル]-3-アジド-4,5-ビス(ベンジルオキシ)オキサン-2-イル]オキシ}-3,4-ジヒドロキシ-6-メトキシオキサン-2-イル]エチル アセタート
(1S)-2-(acetyloxy)-1-[(2S,3S,4S,5S,6R)-5-{[(2R,3R,4R,5S,6R)-6-[(acetyloxy)methyl]-3-azido-4,5-bis(benzyloxy)oxan-2-yl]oxy}-3,4-dihydroxy-6-methoxyoxan-2-yl]ethyl acetate
Other name (1):
1-O-Methyl-2-O-(6-O-acetyl-3-O,4-O-dibenzyl-2-azido-2-deoxy-α-D-glucopyranosyl)-6-O,7-O-diacetyl-α-L-glycero-D-manno-heptopyranose
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