CHEBI:138525 - N-(2-hydroxytridecanoyl)-phytosphingosine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-(2-hydroxytridecanoyl)-phytosphingosine
ChEBI ID CHEBI:138525
ChEBI ASCII Name N-(2-hydroxytridecanoyl)-phytosphingosine
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C31H63NO5
Net Charge 0
Average Mass 529.837
Monoisotopic Mass 529.47062
InChI InChI=1S/C31H63NO5/c1-3-5-7-9-11-13-14-15-17-18-20-22-24-28(34)30(36)27(26-33)32-31(37)29(35)25-23-21-19-16-12-10-8-6-4-2/h27-30,33-36H,3-26H2,1-2H3,(H,32,37)/t27-,28+,29?,30-/m0/s1
InChIKey YELIPOKKMDESCH-KKPBEDLQSA-N
SMILES O[C@@H]([C@@H](O)[C@@H](NC(=O)C(O)CCCCCCCCCCC)CO)CCCCCCCCCCCCCC
ChEBI Ontology
Outgoing N-(2-hydroxytridecanoyl)-phytosphingosine (CHEBI:138525) is a ceramide (CHEBI:17761)
Manual Xref Database
CPD-8449 MetaCyc
View more database links
Last Modified
26 September 2017