CHEBI:43542 - O-(2-aminopropyl)-O'-(2-methyoxyethyl)octa(propylene glycol)

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ChEBI Name O-(2-aminopropyl)-O'-(2-methyoxyethyl)octa(propylene glycol)
ChEBI ID CHEBI:43542
ChEBI ASCII Name O-(2-aminopropyl)-O'-(2-methyoxyethyl)octa(propylene glycol)
Definition A polyether composed of eight propylene glycol units capped at both ends by methoxyethyl and 2−aminopropyl groups (PBD entry:1NGX).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C30H63NO10
Net Charge 0
Average Mass 597.82190
Monoisotopic Mass 597.44520
InChI InChI=1S/C30H63NO10/c1-22(31)13-33-14-23(2)35-16-25(4)37-18-27(6)39-20-29(8)41-21-30(9)40-19-28(7)38-17-26(5)36-15-24(3)34-12-11-32-10/h22-30H,11-21,31H2,1-10H3/t22-,23+,24-,25+,26+,27-,28+,29-,30+/m0/s1
InChIKey ICCXIDTYQFYPNV-UCPYNOCCSA-N
SMILES COCCO[C@@H](C)CO[C@H](C)CO[C@H](C)CO[C@H](C)CO[C@@H](C)CO[C@@H](C)CO[C@H](C)CO[C@H](C)COC[C@H](C)N
Roles Classification
Biological Role(s): epitope
The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing O-(2-aminopropyl)-O'-(2-methyoxyethyl)octa(propylene glycol) (CHEBI:43542) has role epitope (CHEBI:53000)
O-(2-aminopropyl)-O'-(2-methyoxyethyl)octa(propylene glycol) (CHEBI:43542) is a polyether (CHEBI:46774)
IUPAC Name
(6S,9R,12R,15R,18S,21S,24R,27R,31S)-6,9,12,15,18,21,24,27-octamethyl-2,5,8,11,14,17,20,23,26,29-decaoxadotriacontan-31-amine
Synonyms Sources
(10S,13R,16R,19S,22S,25R,28R)-7,10,13,16,19,22,25,28-octamethyl-2,5,9,12,15,18,21,24,27,30-decaoxatritriacontan-32-amine PDBeChem
O-(O-(2-AMINOPROPYL)-O'-(2-METHOXYETHYL)POLYPROPYLENE GLYCOL 500) PDBeChem
Manual Xref Database
JEF PDBeChem
View more database links
Citation Waiting for Citations Type Source
12552112 PubMed citation Europe PMC
Last Modified
13 September 2019