Primary Record
lipid I
- In stock
- 550 g
- Purity
- 98.1 %
Compound Identifiers & Properties
- PubChem CID
- 102011798
- SMILES
- C[C@@H](C(=O)N[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)O)C(=O)O)NC(=O)[C@@H](C)O[C@@H]1[C@H]([C@H](O[C@@H]([C@H]1O)CO)OP(=O)(O)OP(=O)(O)OCC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(/C)\CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)NC(=O)C
- Canonical SMILES
- CC(=O)N[C@H]1[C@@H](OP(=O)(O)OP(=O)(O)OCC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(/C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)O[C@H](CO)[C@@H](O)[C@@H]1O[C@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](CCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)O)C(=O)O
Names & Synonyms
- lipid I
- J1.445.934K
- (2R)-4-{[(1S)-5-amino-1-{[(1R)-1-{[(1R)-1-carboxyethyl]carbamoyl}ethyl]carbamoyl}pentyl]carbamoyl}-2-[(2S)-2-[(2R)-2-{[(2R,3R,4R,5S,6R)-3-acetamido-5-hydroxy-2-{[hydroxy({[hydroxy({[(3Z,7Z,11Z,15Z,19Z,23Z,27Z,31E,35E,39E)-4,8,12,16,20,24,28,32,36,40,44-undecamethylpentatetraconta-3,7,11,15,19,23,27,31,35,39,43-undecaen-1-yl]oxy})phosphoryl]oxy})phosphoryl]oxy}-6-(hydroxymethyl)oxan-4-yl]oxy}propanamido]propanamido]butanoic acid
- 2-O-[1-O-[[[[(3Z,7Z,11Z,15Z,19Z,23Z,27Z,31E,35E,39E)-4,8,12,16,20,24,28,32,36,40,44-Undecamethyl-3,7,11,15,19,23,27,31,35,39,43-pentatetracontaundecene-1-yl]oxy]phosphonyloxy]phosphonyl]-N-acetyl-3-deoxy-alpha-D-glucosamine-3-yl]-D-Lac-L-Ala-D-gammaGlu-L-Lys-D-Ala-D-Ala-OH ester