inositol-P-ceramide B' (C24)

Chemical Formula:

C₄₈H₉₅NO₁₂P

Molecular Weight:

909.25 Daltons

Monoisotopic Mass:

909.667014062 Daltons

SMILES:

CCCCCCCCCCCCCCCCCCCCCC[C@H](O)C(=O)N[C@@H](COP(O[C@H]1([C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@@H](O)1))([O-])=O)[C@@H](CCCCCCCCCCCCCCC)O

InChI:

1S/C48H96NO12P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-41(51)48(57)49-39(40(50)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2)38-60-62(58,59)61-47-45(55)43(53)42(52)44(54)46(47)56/h39-47,50-56H,3-38H2,1-2H3,(H,49,57)(H,58,59)/p-1/t39-,40+,41-,42-,43-,44+,45+,46+,47-/m0/s1

InChIKey:

VNKKSGSHXRHPDZ-LIMFHIGASA-M

Synonyms

Ins-1-P-Cer(d18:0/2-OH-24:0)
inositol-P-ceramide B' (18:0/24:0)
inositol-phospho-ceramide B' (C24)
IPC-2' (C24)
IPC-B' (C24)
inositol-P-ceramide B' (C24)

Databases

MetaCyc: CPD-16376

ChEBI: 65095

MetaNetX: MNXM57474

PubChem (CID): 70678692