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CL(20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z))

PropertiesImage
MNX_IDMNXM123397 Image of MNXM123397
referencehmdb:HMDB0059123
formulaC95H148O17P2
global charge0
mol weight1624.16
InChIKeyASGISDFJFWOCQN-NRSDAKCISA-N
InChIInChI=1S/C95H148O17P2/c1-5-9-13-17-21-25-29-33-37-41-44-48-52-56-60-64-68-72-76-80-93(98)106-86-91(112-95(100)82-78-74-70-66-62-58-54-50-46-43-39-35-31-27-23-19-15-11-7-3)88-110-114(103,104)108-84-89(96)83-107-113(101,102)109-87-90(85-105-92(97)79-75-71-67-63-59-55-51-47-40-36-32-28-24-20-16-12-8-4)111-94(99)81-77-73-69-65-61-57-53-49-45-42-38-34-30-26-22-18-14-10-6-2/h21-28,33-40,44-46,48-51,55-58,60-63,67-70,72-74,89-91,96H,5-20,29-32,41-43,47,52-54,59,64-66,71,75-88H2,1-4H3,(H,101,102)(H,103,104)/b25-21-,26-22-,27-23-,28-24-,37-33-,38-34-,39-35-,40-36-,48-44-,49-45-,50-46-,55-51-,60-56-,61-57-,62-58-,67-63-,72-68-,73-69-,74-70-/t89-,90+,91+/m0/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OC[C@H](COP(=O)(O)OC[C@@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC
MNX internals
InChI (mnx)InChI=1/C95H148O17P2/c1-5-9-13-17-21-25-29-33-37-41-44-48-52-56-60-64-68-72-76-80-93(98)106-86-91(112-95(100)82-78-74-70-66-62-58-54-50-46-43-39-35-31-27-23-19-15-11-7-3)88-110-114(103,104)108-84-89(96)83-107-113(101,102)109-87-90(85-105-92(97)79-75-71-67-63-59-55-51-47-40-36-32-28-24-20-16-12-8-4)111-94(99)81-77-73-69-65-61-57-53-49-45-42-38-34-30-26-22-18-14-10-6-2/h21-28,33-40,44-46,48-51,55-58,60-63,67-70,72-74,89-91,96H,5-20,29-32,41-43,47,52-54,59,64-66,71,75-88H2,1-4H3,(H,101,102)(H,103,104)/b25-21-,26-22-,27-23-,28-24-,37-33-,38-34-,39-35-,40-36-,48-44-,49-45-,50-46-,55-51-,60-56-,61-57-,62-58-,67-63-,72-68-,73-69-,74-70-/t89-,90+,91+/m0/s1 Image of MNXM123397
SMILES (mnx)[CH3:1][CH2:5][CH2:9][CH2:13][CH2:17]/[CH:21]=[CH:25]\[CH2:29]/[CH:33]=[CH:37]\[CH2:41]/[CH:44]=[CH:48]\[CH2:52]/[CH:56]=[CH:60]\[CH2:64]/[CH:68]=[CH:72]\[CH2:76][CH2:80][C:93](=[O:98])[O:106][CH2:86][C@H:91]([CH2:88][O:110][P:114]([OH:103])(=[O:104])[O:108][CH2:84][C@H:89]([CH2:83][O:107][P:113]([OH:101])(=[O:102])[O:109][CH2:87][C@@H:90]([CH2:85][O:105][C:92]([CH2:79][CH2:75][CH2:71]/[CH:67]=[CH:63]\[CH2:59]/[CH:55]=[CH:51]\[CH2:47]/[CH:40]=[CH:36]\[CH2:32]/[CH:28]=[CH:24]\[CH2:20][CH2:16][CH2:12][CH2:8][CH3:4])=[O:97])[O:111][C:94]([CH2:81][CH2:77]/[CH:73]=[CH:69]\[CH2:65]/[CH:61]=[CH:57]\[CH2:53]/[CH:49]=[CH:45]\[CH2:42]/[CH:38]=[CH:34]\[CH2:30]/[CH:26]=[CH:22]\[CH2:18][CH2:14][CH2:10][CH2:6][CH3:2])=[O:99])[OH:96])[O:112][C:95]([CH2:82][CH2:78]/[CH:74]=[CH:70]\[CH2:66]/[CH:62]=[CH:58]\[CH2:54]/[CH:50]=[CH:46]\[CH2:43]/[CH:39]=[CH:35]\[CH2:31]/[CH:27]=[CH:23]\[CH2:19][CH2:15][CH2:11][CH2:7][CH3:3])=[O:100]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0059123
ASGISDFJFWOCQN-NRSDAKCISA-N 		CL(20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z))
(2R)-2,3-bis[(4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoyloxy]propoxy((2S)-3-{[(2R)-2-[(4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoyloxy]-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy)phosphinic acid
1'-[1-(5Z,8Z,11Z,14Z-Eicosatetraenoyl)-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-glycero-3-phospho],3'-[1,2-di(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-rac-glycero-3-phospho]-glycerol
1'-[1-Arachidonoyl-2-osbondoyl-sn-glycero-3-phospho],3'-[1,2-diosbondoyl-rac-glycero-3-phospho]-glycerol
CL(1'-[20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)],3'-[22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)])
CL(20:4/22:5/22:5/22:5)
CL(86:19)
Cardiolipin(20:4/22:5/22:5/22:5)
Cardiolipin(86:19)
[(2R)-2,3-bis[(4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoyloxy]propoxy][(2S)-3-({[(2R)-2-[(4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoyloxy]-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy]phosphinic acid

SLM:000588549
slm:000588549
ASGISDFJFWOCQN-QCUBWNBGSA-L 		Cardiolipin (20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z))
1'-[1-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-2-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-glycero-3-phospho],3'-[1,2-di-(4Z,7Z,10Z,13Z,16Z-docosapentaenoyl)-sn-glycero-3-phospho]-glycerol
CL (20:4(5Z,8Z,11Z,14Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z)/22:5(4Z,7Z,10Z,13Z,16Z))

hmdb:HMDB59123 		secondary/obsolete/fantasy identifier