Search MNXref
SystemsX.ch
The Swiss Initiative in Systems Biology
**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**
 Feedback

beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-di-trans,octa-cis-undecaprenyl diphosphate

PropertiesImagewith InChI numberingOccurences in reactions
MNX_IDMNXM1371159 Image of MNXM1371159 Image of MNXM1371159
#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
formulaC77H126N2O22P2
charge-2
mass1493.793
referencechebi:73988
InChIKeyDTHGKYAZBNWFMJ-RIJYEUHMSA-L
InChIInChI=1S/C77H128N2O22P2/c1-50(2)25-15-26-51(3)27-16-28-52(4)29-17-30-53(5)31-18-32-54(6)33-19-34-55(7)35-20-36-56(8)37-21-38-57(9)39-22-40-58(10)41-23-42-59(11)43-24-44-60(12)45-46-94-102(90,91)101-103(92,93)100-76-67(79-62(14)84)74(70(87)65(49-82)96-76)98-75-66(78-61(13)83)73(69(86)64(48-81)95-75)99-77-72(89)71(88)68(85)63(47-80)97-77/h25,27,29,31,33,35,37,39,41,43,45,63-77,80-82,85-89H,15-24,26,28,30,32,34,36,38,40,42,44,46-49H2,1-14H3,(H,78,83)(H,79,84)(H,90,91)(H,92,93)/p-2/b51-27+,52-29+,53-31-,54-33-,55-35-,56-37-,57-39-,58-41-,59-43-,60-45-/t63-,64-,65-,66-,67-,68+,69+,70+,71+,72-,73-,74-,75-,76-,77+/m1/s1
SMILES[CH3:1][C:50]([CH3:2])=[CH:25][CH2:15][CH2:26]/[C:51]([CH3:3])=[CH:27]/[CH2:16][CH2:28]/[C:52]([CH3:4])=[CH:29]/[CH2:17][CH2:30]/[C:53]([CH3:5])=[CH:31]\[CH2:18][CH2:32]/[C:54]([CH3:6])=[CH:33]\[CH2:19][CH2:34]/[C:55]([CH3:7])=[CH:35]\[CH2:20][CH2:36]/[C:56]([CH3:8])=[CH:37]\[CH2:21][CH2:38]/[C:57]([CH3:9])=[CH:39]\[CH2:22][CH2:40]/[C:58]([CH3:10])=[CH:41]\[CH2:23][CH2:42]/[C:59]([CH3:11])=[CH:43]\[CH2:24][CH2:44]/[C:60]([CH3:12])=[CH:45]\[CH2:46][O:94][P:102]([OH:90])(=[O:91])[O:101][P:103]([OH:92])(=[O:93])[O:100][C@@H:76]1[C@H:67]([N:79]=[C:62]([CH3:14])[OH:84])[C@@H:74]([O:98][C@@H:75]2[C@H:66]([N:78]=[C:61]([CH3:13])[OH:83])[C@@H:73]([O:99][C@H:77]3[C@H:72]([OH:89])[C@@H:71]([OH:88])[C@@H:68]([OH:85])[C@@H:63]([CH2:47][OH:80])[O:97]3)[C@@H:69]([OH:86])[C@@H:64]([CH2:48][OH:81])[O:95]2)[C@@H:70]([OH:87])[C@@H:65]([CH2:49][OH:82])[O:96]1
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:73988
chebi:73988 		beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-di-trans,octa-cis-undecaprenyl diphosphate
beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol(2-)
beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,polycis-undecaprenol(2-)
beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-1-O-{[({[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphinato)oxy]phosphinato}-alpha-D-galactopyranose
metacyc.compound:CPD-15432
metacycM:CPD-15432 		beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-PP-Und
beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl-(1->3)-N-acetyl-alpha-D-galactosaminyldiphospho-ditrans,octacis-undecaprenol
CHEBI:74038
chebi:74038 		beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol
beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,polycis-undecaprenol
beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-alpha-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-1-O-{hydroxy[(hydroxy{[(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30Z,34E,38E)-3,7,11,15,19,23,27,31,35,39,43-undecamethyltetratetraconta-2,6,10,14,18,22,26,30,34,38,42-undecaen-1-yl]oxy}phosphoryl)oxy]phosphoryl}-alpha-D-galactopyranose
seed.compound:cpd31234
seedM:cpd31234 		beta-D-Gal-(1->3)-alpha-D-GalNAc-(1->3)-alpha-D-GalNAc-diphospho-ditrans,octacis-undecaprenol
beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl-(1->3)-N-acetyl-alpha-D-galactosaminyldiphospho-ditrans,octacis-undecaprenol
seedM:M_cpd31234 secondary/obsolete/fantasy identifier