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tri-trans,hepta-cis-undecaprenyl diphosphate

PropertiesImage
MNX_IDMNXM1364355 Image of MNXM1364355
referencechebi:60388
formulaC55H89O7P2
global charge-3
mol weight924.258
InChIKeyNTXGVHCCXVHYCL-RTRZQXHFSA-K
InChIInChI=1S/C55H92O7P2/c1-45(2)23-13-24-46(3)25-14-26-47(4)27-15-28-48(5)29-16-30-49(6)31-17-32-50(7)33-18-34-51(8)35-19-36-52(9)37-20-38-53(10)39-21-40-54(11)41-22-42-55(12)43-44-61-64(59,60)62-63(56,57)58/h23,25,27,29,31,33,35,37,39,41,43H,13-22,24,26,28,30,32,34,36,38,40,42,44H2,1-12H3,(H,59,60)(H2,56,57,58)/p-3/b46-25+,47-27+,48-29+,49-31-,50-33-,51-35-,52-37-,53-39-,54-41-,55-43-
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\COP(=O)([O-])OP(=O)([O-])[O-]
MNX internals
InChI (mnx)InChI=1/C55H92O7P2/c1-45(2)23-13-24-46(3)25-14-26-47(4)27-15-28-48(5)29-16-30-49(6)31-17-32-50(7)33-18-34-51(8)35-19-36-52(9)37-20-38-53(10)39-21-40-54(11)41-22-42-55(12)43-44-61-64(59,60)62-63(56,57)58/h23,25,27,29,31,33,35,37,39,41,43H,13-22,24,26,28,30,32,34,36,38,40,42,44H2,1-12H3,(H,59,60)(H2,56,57,58)/b46-25+,47-27+,48-29+,49-31-,50-33-,51-35-,52-37-,53-39-,54-41-,55-43- Image of MNXM1364355
SMILES (mnx)[CH2:1](/[CH:2]=[C:16](\[CH2:15][CH2:14]/[CH:13]=[C:12](/[CH2:11][CH2:10]/[CH:9]=[C:7](/[CH2:8][CH2:6][CH:5]=[C:4]([CH3:3])[CH3:17])[CH3:18])[CH3:19])[CH3:20])[CH2:21]/[C:22](=[CH:25]\[CH2:24][CH2:23][C:30](=[CH:29][CH2:28][CH2:27][C:35](=[CH:34][CH2:33][CH2:32]/[C:40](=[CH:39]\[CH2:38][CH2:37]/[C:45](=[CH:44]\[CH2:43][CH2:42]/[C:50](=[CH:49]/[CH2:48][CH2:47]/[C:55](=[CH:54]\[CH2:53][CH2:52][O:61]([O:57][P:63](=[O:59])([OH:60])[PH2:64])(=[O:58])[OH:62])[OH:56])[CH3:51])[CH3:46])[CH3:41])[CH3:36])[CH3:31])[CH3:26]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:60388
chebi:60388
NTXGVHCCXVHYCL-RTRZQXHFSA-K
tri-trans,hepta-cis-undecaprenyl diphosphate
(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30E,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 diphosphate
tri-trans,poly-cis-undecaprenyl diphosphate trianion
tri-trans,poly-cis-undecaprenyl diphosphate(3-)

CHEBI:60464
chebi:60464
NTXGVHCCXVHYCL-RTRZQXHFSA-N
tri-trans,poly-cis-undecaprenyl diphosphate
(2Z,6Z,10Z,14Z,18Z,22Z,26Z,30E,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 trihydrogen diphosphate

seed.compound:cpd21094
seedM:cpd21094
NTXGVHCCXVHYCL-RTRZQXHFSA-L
tritrans,heptacis-Undecaprenyl diphosphate
tri-trans,hepta-cis-undecaprenyl diphosphate
tri-trans,hepta-cis-undecaprenyl pyrophosphate
tri-trans-poly-cis-undecaprenyl diphosphate

seedM:M_cpd21094
secondary/obsolete/fantasy identifier