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alpha-D-Glucopyranosyl-diphospho-ditrans,octacis-undecaprenol

PropertiesImagewith InChI numberingOccurences in reactions
MNX_IDMNXM1376203 Image of MNXM1376203 Image of MNXM1376203
#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
formulaC61H102O12P2
charge0
mass1089.421
referencekeggC:C19772
InChIKeyWADQQVAMGZIDFQ-ZMDJJFASSA-N
InChIInChI=1S/C61H102O12P2/c1-46(2)23-13-24-47(3)25-14-26-48(4)27-15-28-49(5)29-16-30-50(6)31-17-32-51(7)33-18-34-52(8)35-19-36-53(9)37-20-38-54(10)39-21-40-55(11)41-22-42-56(12)43-44-70-74(66,67)73-75(68,69)72-61-60(65)59(64)58(63)57(45-62)71-61/h23,25,27,29,31,33,35,37,39,41,43,57-65H,13-22,24,26,28,30,32,34,36,38,40,42,44-45H2,1-12H3,(H,66,67)(H,68,69)/b47-25+,48-27+,49-29-,50-31-,51-33-,52-35-,53-37-,54-39-,55-41-,56-43-/t57-,58-,59+,60-,61-/m1/s1
SMILES[CH3:1][C:46]([CH3:2])=[CH:23][CH2:13][CH2:24]/[C:47]([CH3:3])=[CH:25]/[CH2:14][CH2:26]/[C:48]([CH3:4])=[CH:27]/[CH2:15][CH2:28]/[C:49]([CH3:5])=[CH:29]\[CH2:16][CH2:30]/[C:50]([CH3:6])=[CH:31]\[CH2:17][CH2:32]/[C:51]([CH3:7])=[CH:33]\[CH2:18][CH2:34]/[C:52]([CH3:8])=[CH:35]\[CH2:19][CH2:36]/[C:53]([CH3:9])=[CH:37]\[CH2:20][CH2:38]/[C:54]([CH3:10])=[CH:39]\[CH2:21][CH2:40]/[C:55]([CH3:11])=[CH:41]\[CH2:22][CH2:42]/[C:56]([CH3:12])=[CH:43]\[CH2:44][O:70][P:74]([OH:66])(=[O:67])[O:73][P:75]([OH:68])(=[O:69])[O:72][C@@H:61]1[C@H:60]([OH:65])[C@@H:59]([OH:64])[C@H:58]([OH:63])[C@@H:57]([CH2:45][OH:62])[O:71]1
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Similar chemical compounds in external resources
IdentifierDescription
kegg.compound:C19772
keggC:C19772
alpha-D-Glucopyranosyl-diphospho-ditrans,octacis-undecaprenol
keggC:M_C19772 secondary/obsolete/fantasy identifier