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(galactosaminyl)2-N,N'-diacetylbacillosaminyl-alpha1-diphospho-di-trans,octa-cis-undecaprenol

PropertiesImagewith InChI numberingOccurences in reactions
MNX_IDMNXM97367 Image of MNXM97367 Image of MNXM97367
#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 0
formulaC77H126N2O21P2
charge-2
mass1477.794
referenceseedM:cpd24278
InChIKeyYLBMEMMUCQFJPH-QOXIPRKZSA-L
InChIInChI=1S/C77H128N2O21P2/c1-50(2)26-16-27-51(3)28-17-29-52(4)30-18-31-53(5)32-19-33-54(6)34-20-35-55(7)36-21-37-56(8)38-22-39-57(9)40-23-41-58(10)42-24-43-59(11)44-25-45-60(12)46-47-93-101(89,90)100-102(91,92)99-75-67(79-63(15)83)74(66(61(13)94-75)78-62(14)82)98-77-72(88)70(86)73(65(49-81)96-77)97-76-71(87)69(85)68(84)64(48-80)95-76/h26,28,30,32,34,36,38,40,42,44,46,61,64-77,80-81,84-88H,16-25,27,29,31,33,35,37,39,41,43,45,47-49H2,1-15H3,(H,78,82)(H,79,83)(H,89,90)(H,91,92)/p-2/b51-28+,52-30+,53-32+,54-34-,55-36-,56-38-,57-40-,58-42-,59-44-,60-46-/t61-,64-,65-,66-,67-,68+,69+,70-,71-,72-,73+,74+,75-,76-,77-/m1/s1
SMILES[CH3:1][C:50]([CH3:2])=[CH:26][CH2:16][CH2:27]/[C:51]([CH3:3])=[CH:28]/[CH2:17][CH2:29]/[C:52]([CH3:4])=[CH:30]/[CH2:18][CH2:31]/[C:53]([CH3:5])=[CH:32]/[CH2:19][CH2:33]/[C:54]([CH3:6])=[CH:34]\[CH2:20][CH2:35]/[C:55]([CH3:7])=[CH:36]\[CH2:21][CH2:37]/[C:56]([CH3:8])=[CH:38]\[CH2:22][CH2:39]/[C:57]([CH3:9])=[CH:40]\[CH2:23][CH2:41]/[C:58]([CH3:10])=[CH:42]\[CH2:24][CH2:43]/[C:59]([CH3:11])=[CH:44]\[CH2:25][CH2:45]/[C:60]([CH3:12])=[CH:46]\[CH2:47][O:93][P:101]([OH:89])(=[O:90])[O:100][P:102]([OH:91])(=[O:92])[O:99][C@@H:75]1[C@H:67]([N:79]=[C:63]([CH3:15])[OH:83])[C@@H:74]([O:98][C@@H:77]2[C@H:72]([OH:88])[C@@H:70]([OH:86])[C@@H:73]([O:97][C@@H:76]3[C@H:71]([OH:87])[C@@H:69]([OH:85])[C@@H:68]([OH:84])[C@@H:64]([CH2:48][OH:80])[O:95]3)[C@@H:65]([CH2:49][OH:81])[O:96]2)[C@H:66]([N:78]=[C:62]([CH3:14])[OH:82])[C@@H:61]([CH3:13])[O:94]1
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Similar chemical compounds in external resources
IdentifierDescription
seed.compound:cpd24278
seedM:cpd24278 		(galactosaminyl)2-N,N'-diacetylbacillosaminyl-alpha1-diphospho-di-trans,octa-cis-undecaprenol
(galactosyl)2-N,N'-diacetylbacillosaminyl-alpha1-diphospho-di-trans,octa-cis-undecaprenol
beta-D-galactosyl-(1->4)-alpha-D-galactosyl-(1->3)-N,N'-diacetyl-alpha-D-bacillosaminyl-diphospho-di-trans,octa-cis-undecaprenol
galactosaminyl-beta1,4-galactosaminyl-alpha1,3-N,N'-diacetylbacillosaminyl-alpha1-diphospho-di-trans,octa-cis-undecaprenol
metacyc.compound:CPD-14296
metacycM:CPD-14296 		beta-D-galactosyl-(1->4)-alpha-D-galactosyl-(1->3)-N,N'-diacetyl-alpha-D-bacillosaminyl-diphospho-di-trans,octa-cis-undecaprenol
(galactosyl)2-N,N'-diacetylbacillosaminyl-alpha1-diphospho-di-trans,octa-cis-undecaprenol
seedM:M_cpd24278 secondary/obsolete/fantasy identifier