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inositol phosphomannosylinositol phosphoceramide C (C26)

PropertiesImage
MNX_IDMNXM156797 Image of MNXM156797
referencemetacycM:CPD-16370
formulaC62H119NO26P2
global charge-2
mol weight1356.563
InChIKeyDBKQSCMOMGQYBE-MRPRWLMYSA-L
InChIInChI=1S/C62H121NO26P2/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-43(65)61(79)63-41(45(66)42(64)37-35-33-31-29-27-16-14-12-10-8-6-4-2)39-84-90(80,81)89-60-56(77)52(73)51(72)55(76)59(60)87-62-57(78)47(68)46(67)44(86-62)40-85-91(82,83)88-58-53(74)49(70)48(69)50(71)54(58)75/h41-60,62,64-78H,3-40H2,1-2H3,(H,63,79)(H,80,81)(H,82,83)/p-2/t41-,42+,43-,44+,45-,46+,47-,48-,49-,50+,51+,52+,53+,54+,55-,56+,57-,58-,59+,60+,62?/m0/s1
SMILESCCCCCCCCCCCCCCCCCCCCCCCC[C@H](O)C(=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](COP(=O)([O-])O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@@H]1O)[C@H](O)[C@H](O)CCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C62H121NO26P2/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-43(65)61(79)63-41(45(66)42(64)37-35-33-31-29-27-16-14-12-10-8-6-4-2)39-84-90(80,81)89-60-56(77)52(73)51(72)55(76)59(60)87-62-57(78)47(68)46(67)44(86-62)40-85-91(82,83)88-58-53(74)49(70)48(69)50(71)54(58)75/h41-60,62,64-78H,3-40H2,1-2H3,(H,63,79)(H,80,81)(H,82,83)/t41-,42+,43-,44+,45-,46+,47-,48-,49-,50+,51+,52+,53+,54+,55-,56+,57-,58-,59+,60+,62?/m0/s1 Image of MNXM156797
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][C@@H:43]([C:61](=[N:63][C@@H:41]([CH2:39][O:84][P:90]([OH:80])(=[O:81])[O:89][C@@H:60]1[C@H:56]([OH:77])[C@H:52]([OH:73])[C@@H:51]([OH:72])[C@H:55]([OH:76])[C@H:59]1[O:87][CH:62]1[C@@H:57]([OH:78])[C@@H:47]([OH:68])[C@H:46]([OH:67])[C@@H:44]([CH2:40][O:85][P:91]([OH:82])(=[O:83])[O:88][C@H:58]2[C@H:53]([OH:74])[C@@H:49]([OH:70])[C@H:48]([OH:69])[C@@H:50]([OH:71])[C@H:54]2[OH:75])[O:86]1)[C@@H:45]([C@@H:42]([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:64])[OH:66])[OH:79])[OH:65]
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

metacyc.compound:CPD-16370
metacycM:CPD-16370
DBKQSCMOMGQYBE-MRPRWLMYSA-L 		inositol phosphomannosylinositol phosphoceramide C (C26)
Ins-1-P-6-Man-beta1-2-Ins-1-P-Cer(t18:0/2-OH-26:0)
MIP2C (C26)
inositol phosphomannosylinositol phosphoceramide (18:0/26:0)
inositol phosphomannosylinositol phosphoceramide (C26)

SLM:000509118
slm:000509118
DBKQSCMOMGQYBE-XSXXKTRLSA-L 		Inositol phosphomannosylinositol-1-phospho-N-(2-hydroxyhexacosanoyl)-4R-hydroxysphinganine
Inositol phosphomannosylinositol-1-phospho-N-2-hydroxyhexacosanoyl-4-hydroxysphinganine
Inositol phosphomannosylinositol-1-phosphoceramide (t18:0/26:0(2OH))
M(IP)2C(t18:0/26:0(2OH))
N-(2-hydroxy-hexacosanoyl)-4R-hydroxysphinganine-1-O-[inositol-1-phosphoryl-6-mannosyl-alpha1-2-inositol-1-phosphate]

seed.compound:cpd31875
seedM:cpd31875
DBKQSCMOMGQYBE-MRPRWLMYSA-L 		Ins-1-P-6-Man-beta1-2-Ins-1-P-Cer(t18:0/2-OH-26:0)
MIP2C (C26)
inositol phosphomannosylinositol phosphoceramide (18:0/26:0)
inositol phosphomannosylinositol phosphoceramide (C26)
inositol phosphomannosylinositol phosphoceramide C (C26)

seedM:M_cpd31875 		secondary/obsolete/fantasy identifier