(2R,4S,5R,6R)-5-AMINO-6-(2-{[(2R,4S,5R,6R)-5-AMINO-2-CARBOXY-4-HYDROXY-6-(1,2,3-TRIHYDROXYPROPYL)OXAN-2-YL]OXY}-1,2-DIHYDROXYETHYL)-2-{[(2S,3S,4R,5R,6S)-2-{[(2R,3S,4S,5S,6S)-2-{[(2S,3R,4S,5S,6R)-4-{[(2R,4S,5R,6R)-5-AMINO-2-CARBOXY-4-HYDROXY-6-(1,2,3-TRIHYDROXYPROPYL)OXAN-2-YL]OXY}-6-{[(2R,3S,4R,5R,6R)-4,5-DIHYDROXY-6-{[(4E)-3-HYDROXY-1-OCTADECANAMIDOOCTADEC-4-EN-2-YL]OXY}-2-(HYDROXYMETHYL)OXAN-3-YL]OXY}-5-HYDROXY-2-(HYDROXYMETHYL)OXAN-3-YL]OXY}-3-ACETAMIDO-5-HYDROXY-6-(HYDROXYMETHYL)OXAN-4-YL]OXY}-3,5-DIHYDROXY-6-(HYDROXYMETHYL)OXAN-4-YL]OXY}-4-HYDROXYOXANE-2-CARBOXYLIC ACID

化合物标识与属性

CAS

59247-13-1

PubChem CID

3085154

SMILES

CCCCCCCCCCCCCCCCCC(=O)NCC(C(C=CCCCCCCCCCCCCC)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@@H]2[C@H]([C@@H]([C@@H]([C@@H](O2)CO)O[C@@H]3[C@H]([C@@H]([C@@H]([C@@H](O3)CO)O)O[C@@H]4[C@H]([C@@H]([C@@H]([C@@H](O4)CO)O)O[C@]5(C[C@@H]([C@H]([C@@H](O5)C(C(O)O[C@]6(C[C@@H]([C@H]([C@@H](O6)C(C(CO)O)O)N)O)C(=O)O)O)N)O)C(=O)O)O)NC(=O)C)O[C@]7(C[C@@H]([C@H]([C@@H](O7)C(C(CO)O)O)N)O)C(=O)O)O)O)O

Canonical SMILES

CCCCCCCCCCCCCC=CC(O)C(CNC(=O)CCCCCCCCCCCCCCCCC)O[C@@H]1O[C@H](CO)[C@@H](O[C@H]2O[C@@H](CO)[C@@H](O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O[C@H]4O[C@@H](CO)[C@@H](O)[C@@H](O[C@@]5(C(=O)O)C[C@H](O)[C@@H](N)[C@H](C(O)C(O)O[C@@]6(C(=O)O)C[C@H](O)[C@@H](N)[C@H](C(O)C(O)CO)O6)O5)[C@@H]4O)[C@@H]3NC(C)=O)[C@@H](O[C@@]3(C(=O)O)C[C@H](O)[C@@H](N)[C@H](C(O)C(O)CO)O3)[C@@H]2O)[C@H](O)[C@H]1O