CHEBI:58603 - lipid IVA(4−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name lipid IVA(4−)
ChEBI ID CHEBI:58603
ChEBI ASCII Name lipid IVA(4-)
Definition Tetraanion of lipid IVA.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C68H126N2O23P2
Net Charge -4
Average Mass 1401.67520
Monoisotopic Mass 1400.82486
InChI InChI=1S/C68H130N2O23P2/c1-5-9-13-17-21-25-29-33-37-41-51(72)45-57(76)69-61-65(90-59(78)47-53(74)43-39-35-31-27-23-19-15-11-7-3)63(80)56(89-68(61)93-95(84,85)86)50-87-67-62(70-58(77)46-52(73)42-38-34-30-26-22-18-14-10-6-2)66(64(55(49-71)88-67)92-94(81,82)83)91-60(79)48-54(75)44-40-36-32-28-24-20-16-12-8-4/h51-56,61-68,71-75,80H,5-50H2,1-4H3,(H,69,76)(H,70,77)(H2,81,82,83)(H2,84,85,86)/p-4/t51-,52-,53-,54-,55-,56-,61-,62-,63-,64-,65-,66-,67-,68-/m1/s1
InChIKey KVJWZTLXIROHIL-QDORLFPLSA-J
SMILES CCCCCCCCCCC[C@@H](O)CC(=O)N[C@H]1[C@H](O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](OP([O-])([O-])=O)[C@H](OC(=O)C[C@H](O)CCCCCCCCCCC)[C@H]2NC(=O)C[C@H](O)CCCCCCCCCCC)[C@@H](O)[C@@H]1OC(=O)C[C@H](O)CCCCCCCCCCC)OP([O-])([O-])=O
ChEBI Ontology
Outgoing lipid IVA(4−) (CHEBI:58603) is a a lipid IVA(4−) (CHEBI:176425)
lipid IVA(4−) (CHEBI:58603) is a lipid IVA oxoanion (CHEBI:60373)
lipid IVA(4−) (CHEBI:58603) is conjugate base of lipid IVA (CHEBI:29056)
Incoming lipid IVA (CHEBI:29056) is conjugate acid of lipid IVA(4−) (CHEBI:58603)
IUPAC Name
2-deoxy-6-O-(2-deoxy-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-4-O-phosphonato-β-D-glucopyranosyl)-3-O-[(3R)-3-hydroxytetradecanoyl]-2-[(3R)-3-hydroxytetradecanamido]-1-O-phosphonato-α-D-glucopyranose
Synonym Source
lipid IVA (E. coli) UniProt
Last Modified
18 April 2017