CHEBI:230936 - Hypromellosum

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Hypromellosum
ChEBI ID CHEBI:230936
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C32H60O19
Net Charge 0
Average Mass 748.813
Monoisotopic Mass 748.37288
InChI InChI=1S/C32H60O19/c1-15(34)10-44-14-20-25(27(45-11-16(2)35)29(31(43-8)48-20)46-12-17(3)36)51-32-28(42-7)26(41-6)24(19(49-32)13-39-4)50-30-22(38)21(37)23(40-5)18(9-33)47-30/h15-38H,9-14H2,1-8H3
InChIKey VUKAUDKDFVSVFT-UHFFFAOYSA-N
SMILES O(C1C(OCC(O)C)C(OCC(O)C)C(OC1COCC(O)C)OC)C2OC(C(OC3OC(C(OC)C(O)C3O)CO)C(OC)C2OC)COC
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). See: MetaboLights Study
ChEBI Ontology
Outgoing Hypromellosum (CHEBI:230936) is a organic molecular entity (CHEBI:50860)
IUPAC Name
2-[6-[4,5-bis(2-hydroxypropoxy)-2-(2-hydroxypropoxymethyl)-6-methoxyoxan-3-yl]oxy-4,5-dimethoxy-2-(methoxymethyl)oxan-3-yl]oxy-6-(hydroxymethyl)-5-methoxyoxane-3,4-diol
Manual Xrefs Databases
21242880 ChemSpider
HMDB0256007 HMDB
View more database links