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Man-1-6-Ins-1-P-Cer(d18:0/26:0)

PropertiesImage
MNX_IDMNXM106432 Image of MNXM106432
referencechebi:62706
formulaC56H110NO16P
global charge0
mol weight1084.461
InChIKeyULGWLVJPHSVAOJ-MIMKHQOHSA-N
InChIInChI=1S/C56H110NO16P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-46(60)57-43(44(59)39-37-35-33-31-29-27-16-14-12-10-8-6-4-2)42-70-74(68,69)73-55-52(66)50(64)49(63)51(65)54(55)72-56-53(67)48(62)47(61)45(41-58)71-56/h43-45,47-56,58-59,61-67H,3-42H2,1-2H3,(H,57,60)(H,68,69)/t43-,44+,45+,47+,48-,49+,50+,51-,52+,53-,54+,55+,56?/m0/s1
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP(=O)(O)O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)[C@H](O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C56H110NO16P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-46(60)57-43(44(59)39-37-35-33-31-29-27-16-14-12-10-8-6-4-2)42-70-74(68,69)73-55-52(66)50(64)49(63)51(65)54(55)72-56-53(67)48(62)47(61)45(41-58)71-56/h43-45,47-56,58-59,61-67H,3-42H2,1-2H3,(H,57,60)(H,68,69)/t43-,44+,45+,47+,48-,49+,50+,51-,52+,53-,54+,55+,56?/m0/s1 Image of MNXM106432
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][C:46](=[N:57][C@@H:43]([CH2:42][O:70][P:74]([OH:68])(=[O:69])[O:73][C@@H:55]1[C@H:52]([OH:66])[C@H:50]([OH:64])[C@@H:49]([OH:63])[C@H:51]([OH:65])[C@H:54]1[O:72][CH:56]1[C@@H:53]([OH:67])[C@@H:48]([OH:62])[C@H:47]([OH:61])[C@@H:45]([CH2:41][OH:58])[O:71]1)[C@@H:44]([CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:59])[OH:60]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:62706
chebi:62706
ULGWLVJPHSVAOJ-MIMKHQOHSA-N 		Man-1-6-Ins-1-P-Cer(d18:0/26:0)
(2S,3S)-2-(hexacosanoylamino)-3-hydroxyoctadecanyl (1R,2R,3R,4R,5S,6R)-2,3,4,5-tetrahydroxy-6-(D-mannopyranosyloxy)cyclohexyl hydrogen phosphate
1D-6-O-(D-mannopyranosyl)-myo-inositol 1-[(2S,3S)-2-(hexacosanoylamino)-3-hydroxyoctadecanyl hydrogen phosphate]
MIPC-1
MIPC-A
mannose-inositol-P-ceramide-A

seed.compound:cpd32606
seedM:cpd32606
ULGWLVJPHSVAOJ-MIMKHQOHSA-M 		MIPC-1
MIPC-A
Man-1-2-Ins-1-P-Cer(d18:0/26:0)
mannose-inositol-P-ceramide-A
mannosylinositol phosphorylceramide A (C26)

SLM:000509000
slm:000509000
ULGWLVJPHSVAOJ-MIMKHQOHSA-M 		Mannosylinositol-1-phospho-N-(hexacosanoyl)-sphinganine
MIPC(d18:0/26:0)
Mannosylinositol-1-phospho-N-hexacosanoyl-sphinganine
Mannosylinositol-1-phosphoceramide (d18:0/26:0)
N-(hexacosanoyl)-sphinganine-1-O-[D-mannopyranosyl-alpha1-2-myo-inositol-1-phosphate]

metacyc.compound:CPD-16388
metacycM:CPD-16388
ULGWLVJPHSVAOJ-MIMKHQOHSA-N 		mannosylinositol phosphorylceramide A (C26)
MIPC-1
MIPC-A
Man-1-2-Ins-1-P-Cer(d18:0/26:0)
mannose-inositol-P-ceramide-A

seedM:M_cpd32606 		secondary/obsolete/fantasy identifier