Chemical Compound

J2.190.892D

J2.190.892D chemical structure
Primary Record

J2.190.892D

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
177540319
SMILES
CCCCCCCCCCCCC(=O)O[C@@H](CCCCCCCCCC)CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)OP(=O)(O)O)NC(=O)C[C@H](CCCCCCCCCC)O)OC(=O)C[C@H](CCCCCCCCCC)O)O)CO[C@@]3(C[C@H]([C@H]([C@H](O3)C(CN)O)O[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)[C@@H](COP(=O)(O)O[C@@H](CO)C(=O)O)O[C@@H]5[C@H]([C@H]([C@@H]([C@H](O5)[C@@H](CO)O)O)O)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O)O[C@@H]7[C@H]([C@H]([C@@H]([C@H](O7)[C@@H](CO)O)O)O)O)OP(=O)(O)OP(=O)(O)OCCN)C(=O)O)OP(=O)(O)O)OC(=O)C[C@H](CCCCCCCCCC)OC(=O)CCCCCCCCCCCC
Canonical SMILES
CCCCCCCCCCCCC(=O)O[C@@H](CCCCCCCCCC)CC(=O)N[C@H]1[C@H](OC[C@H]2O[C@H](OP(=O)(O)O)[C@H](NC(=O)C[C@@H](O)CCCCCCCCCC)[C@@H](OC(=O)C[C@@H](O)CCCCCCCCCC)[C@@H]2O)O[C@H](CO[C@]2(C(=O)O)C[C@@H](OP(=O)(O)OP(=O)(O)OCCN)[C@@H](O[C@H]3O[C@H]([C@@H](COP(=O)(O)O[C@@H](CO)C(=O)O)O[C@H]4O[C@H]([C@H](O)CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](O)[C@H](O)[C@@H]3O[C@H]3O[C@H]([C@H](O)CO)[C@@H](O)[C@H](O)[C@@H]3O)[C@@H](C(O)CN)O2)[C@@H](OP(=O)(O)O)[C@@H]1OC(=O)C[C@H](CCCCCCCCCC)OC(=O)CCCCCCCCCCCC

Names & Synonyms

  • J2.190.892D
  • (2R,4R,5S,6R)-6-(2-amino-1-hydroxyethyl)-4-[({[(2-aminoethoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl)oxy]-5-{[(2R,3S,4S,5S,6S)-6-[(1R)-2-({[(1S)-1-carboxy-2-hydroxyethoxy](hydroxy)phosphoryl}oxy)-1-{[(2S,3S,4S,5S,6R)-6-[(1R)-1,2-dihydroxyethyl]-4,5-dihydroxy-3-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}ethyl]-3-{[(2R,3S,4S,5S,6R)-6-[(1R)-1,2-dihydroxyethyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-4,5-dihydroxyoxan-2-yl]oxy}-2-{[(2R,3S,4R,5R,6R)-6-{[(2R,3S,4R,5R,6R)-3-hydroxy-5-[(3S)-3-hydroxytridecanamido]-4-{[(3S)-3-hydroxytridecanoyl]oxy}-6-(phosphonooxy)oxan-2-yl]methoxy}-3-(phosphonooxy)-5-[(3S)-3-(tridecanoyloxy)tridecanamido]-4-{[(3S)-3-(tridecanoyloxy)tridecanoyl]oxy}oxan-2-yl]methoxy}oxane-2-carboxylic acid
  • 6-O-[6-O-[4-O-[6-O-(2-O-alpha-D-Glucopyranosyl-alpha-D-glycero-D-manno-heptopyranosyl)-7-O-[[(S)-1-carboxy-2-hydroxyethoxy]phosphonyl]-2-O-alpha-D-glycero-D-manno-heptopyranosyl-alpha-D-glycero-D-manno-heptopyranosyl]-6-C-(aminomethyl)-3-O-(2-aminoethoxyphosphonyloxyphosphonyl)-1-carboxy-2-deoxy-alpha-D-lyxo-hexopyranosyl]-4-O-phosphono-3-O-[(3S)-3-(tridecanoyloxy)tridecanoyl]-2-[[(3S)-3-(tridecanoyloxy)tridecanoyl]amino]-2-deoxy-beta-D-glucopyranosyl]-3-O-[(S)-3-hydroxytridecanoyl]-2-[[(S)-3-hydroxytridecanoyl]amino]-2-deoxy-alpha-D-glucopyranose 1-phosphoric acid