Chem
J-GLOBAL ID：200907077819558550   Nikkaji number：J782.757A

(1α,4α)-N-[2-[3-O-(Sodiooxysulfonyl)-β-D-galactopyranosyloxy]ethyl]-7-oxabicyclo[2.2.1]hept-5-ene-2α-carboxamide

(1α,4α)-N-[2-[3-O-(ソジオオキシスルホニル)-β-D-ガラクトピラノシルオキシ]エチル]-7-オキサビシクロ[2.2.1]ヘプタ-5-エン-2α-カルボアミド
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： C15H22NNaO11S
Molecular formula furigana： C15-H22-N-NA-O11-S
Molecular weight： 447.390
InChI： InChI=1S/C15H23NO11S.Na/c17-6-10-11(18)13(27-28(21,22)23)12(19)15(26-10)24-4-3-16-14(20)8-5-7-1-2-9(8)25-7;/h1-2,7-13,15,17-19H,3-6H2,(H,16,20)(H,21,22,23);/q;+1/p-1/t7-,8-,9+,10-,11+,12-,13+,15-;/m1./s1
InChI key： PCEUTENVTMQWBZ-VGOONDJOSA-M
SMILES： OC[C@H]1O[C@@H](OCCNC(=O)[C@@H]2C[C@@H]3O[C@H]2C=C3)[C@H](O)[C@@H](OS(=O)(=O)O[Na])[C@H]1O
Systematic name  (3)：
  • (1α,4α)-N-[2-[3-O-(ソジオオキシスルホニル)-β-D-ガラクトピラノシルオキシ]エチル]-7-オキサビシクロ[2.2.1]ヘプタ-5-エン-2α-カルボアミド
  • (2R,3S,4S,5R,6R)-3,5-ジヒドロキシ-2-(ヒドロキシメチル)-6-(2-{[(1S,2R,4S)-7-オキサビシクロ[2.2.1]ヘプタ-5-エン-2-イル]ホルムアミド}エトキシ)オキサン-4-イル ナトリウム スルファート
  • (2R,3S,4S,5R,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-(2-{[(1S,2R,4S)-7-oxabicyclo[2.2.1]hept-5-en-2-yl]formamido}ethoxy)oxan-4-yl sodium sulfate
Other name (1)：
  • (1α,4α)-N-[2-[3-O-(Sodiooxysulfonyl)-β-D-galactopyranosyloxy]ethyl]-7-oxabicyclo[2.2.1]hept-5-ene-2α-carboxamide
Thsaurus map：
Thesaurus Map

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