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Beta-D-Mannosyldiacetylchitobiosyldiphosphodolichol, human uterine homolog

MNXM10806 is deprecated and here replaced by MNXM1101246
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1101246 Image of MNXM1101246
referencebiggM:mpdol_U
formulaC47H80N2O22P2
global charge-2
mol weight1087.097
InChIKeyCMBCFQGXXHOGEH-LSMBNOQWSA-L
InChIInChI=1S/C47H82N2O22P2/c1-26(2)13-9-14-27(3)15-10-16-28(4)17-11-18-29(5)19-12-20-30(6)21-22-64-72(60,61)71-73(62,63)70-46-37(49-32(8)54)40(57)43(35(25-52)67-46)68-45-36(48-31(7)53)39(56)44(34(24-51)66-45)69-47-42(59)41(58)38(55)33(23-50)65-47/h13,15,17,19,30,33-47,50-52,55-59H,9-12,14,16,18,20-25H2,1-8H3,(H,48,53)(H,49,54)(H,60,61)(H,62,63)/p-2/b27-15+,28-17+,29-19+/t30?,33-,34-,35-,36-,37-,38-,39-,40-,41+,42+,43-,44-,45+,46-,47+/m1/s1
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)[C@@H](OP(=O)([O-])OP(=O)([O-])OCCC(C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)O[C@@H]2CO)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C47H82N2O22P2/c1-26(2)13-9-14-27(3)15-10-16-28(4)17-11-18-29(5)19-12-20-30(6)21-22-64-72(60,61)71-73(62,63)70-46-37(49-32(8)54)40(57)43(35(25-52)67-46)68-45-36(48-31(7)53)39(56)44(34(24-51)66-45)69-47-42(59)41(58)38(55)33(23-50)65-47/h13,15,17,19,30,33-47,50-52,55-59H,9-12,14,16,18,20-25H2,1-8H3,(H,48,53)(H,49,54)(H,60,61)(H,62,63)/b27-15+,28-17+,29-19+/t30?,33-,34-,35-,36-,37-,38-,39-,40-,41+,42+,43-,44-,45+,46-,47+/m1/s1 Image of MNXM1101246
SMILES (mnx)[CH3:1][C:26]([CH3:2])=[CH:13][CH2:9][CH2:14]/[C:27]([CH3:3])=[CH:15]/[CH2:10][CH2:16]/[C:28]([CH3:4])=[CH:17]/[CH2:11][CH2:18]/[C:29]([CH3:5])=[CH:19]/[CH2:12][CH2:20][CH:30]([CH3:6])[CH2:21][CH2:22][O:64][P:72]([OH:60])(=[O:61])[O:71][P:73]([OH:62])(=[O:63])[O:70][C@@H:46]1[C@H:37]([N:49]=[C:32]([CH3:8])[OH:54])[C@@H:40]([OH:57])[C@H:43]([O:68][C@H:45]2[C@H:36]([N:48]=[C:31]([CH3:7])[OH:53])[C@@H:39]([OH:56])[C@H:44]([O:69][C@H:47]3[C@@H:42]([OH:59])[C@@H:41]([OH:58])[C@H:38]([OH:55])[C@@H:33]([CH2:23][OH:50])[O:65]3)[C@@H:34]([CH2:24][OH:51])[O:66]2)[C@@H:35]([CH2:25][OH:52])[O:67]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:mpdol_U
biggM:mpdol_U
CMBCFQGXXHOGEH-LSMBNOQWSA-L 		Beta-D-Mannosyldiacetylchitobiosyldiphosphodolichol, human uterine homolog
hmdb:HMDB0011673
CMBCFQGXXHOGEH-LSMBNOQWSA-N 		Beta-1,4-D-Mannosylchitobiosyldiphosphodolichol
Man-beta1->4glcnac-beta1->4glcnac-PP-dol
N-[(2S,3R,4R,5S,6R)-4-Hydroxy-2-{[(2R,3S,4R,5R,6R)-4-hydroxy-6-{[hydroxy({[hydroxy({[(6E,10E,14E)-3,7,11,15,19-pentamethylicosa-6,10,14,18-tetraen-1-yl]oxy})phosphoryl]oxy})phosphoryl]oxy}-5-[(1-hydroxyethylidene)amino]-2-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)-5-{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-3-yl]ethanimidate
[(2R,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy({hydroxy[(6E,10E,14E)-3,7,11,15,19-pentamethylicosa-6,10,14,18-tetraen-1-yl]oxyphosphoryl}oxy)phosphinic acid
b-(1->4)-D-mannosylchitobiosyldiphosphodolichol
b-1,4-D-Mannosylchitobiosyldiphosphodolichol
beta-(1->4)-D-mannosylchitobiosyldiphosphodolichol
beta-(1->4)-delta-mannosylchitobiosyldiphosphodolichol
beta-1,4-D-mannosylchitobiosyldiphosphodolichol
beta-1,4-delta-Mannosylchitobiosyldiphosphodolichol
beta-D-Mannosyldiacetylchitobiosyldiphosphodolichol
beta-delta-Mannosyldiacetylchitobiosyldiphosphodolichol
{[(2R,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}({[hydroxy({[(6E,10E,14E)-3,7,11,15,19-pentamethylicosa-6,10,14,18-tetraen-1-yl]oxy})phosphoryl]oxy})phosphinic acid

vmhM:mpdol_L
vmhmetabolite:mpdol_L
CMBCFQGXXHOGEH-LSMBNOQWSA-N 		beta-D-Mannosyldiacetylchitobiosyldiphosphodolichol, human liver homolog
{[(2R,3R,4R,5S,6R)-3-acetamido-5-{[(2S,3R,4R,5S,6R)-3-acetamido-4-hydroxy-6-(hydroxymethyl)-5-{[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydr

hmdb:HMDB11673
biggM:M_mpdol_U
vmhM:M_mpdol_L 		secondary/obsolete/fantasy identifier