Search MNXref
 Feedback

CL(22:5(7Z,10Z,13Z,16Z,19Z)/18:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z))

PropertiesImage
MNX_IDMNXM123703 Image of MNXM123703
referencehmdb:HMDB0059417
formulaC89H152O17P2
global charge0
mol weight1556.126
InChIKeyBOQCJUSBHWGLQU-FYNIRSDJSA-N
InChIInChI=1S/C89H152O17P2/c1-5-9-13-17-21-25-29-33-37-39-41-43-47-49-53-57-61-65-69-73-86(91)99-79-84(105-88(93)75-71-67-63-59-55-51-45-35-31-27-23-19-15-11-7-3)81-103-107(95,96)101-77-83(90)78-102-108(97,98)104-82-85(106-89(94)76-72-68-64-60-56-52-46-36-32-28-24-20-16-12-8-4)80-100-87(92)74-70-66-62-58-54-50-48-44-42-40-38-34-30-26-22-18-14-10-6-2/h9-10,13-14,21-22,25-26,33-35,37-38,41-45,49-50,53-54,83-85,90H,5-8,11-12,15-20,23-24,27-32,36,39-40,46-48,51-52,55-82H2,1-4H3,(H,95,96)(H,97,98)/b13-9-,14-10-,25-21-,26-22-,37-33-,38-34-,43-41-,44-42-,45-35-,53-49-,54-50-/t83-,84-,85-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)OC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C89H152O17P2/c1-5-9-13-17-21-25-29-33-37-39-41-43-47-49-53-57-61-65-69-73-86(91)99-79-84(105-88(93)75-71-67-63-59-55-51-45-35-31-27-23-19-15-11-7-3)81-103-107(95,96)101-77-83(90)78-102-108(97,98)104-82-85(106-89(94)76-72-68-64-60-56-52-46-36-32-28-24-20-16-12-8-4)80-100-87(92)74-70-66-62-58-54-50-48-44-42-40-38-34-30-26-22-18-14-10-6-2/h9-10,13-14,21-22,25-26,33-35,37-38,41-45,49-50,53-54,83-85,90H,5-8,11-12,15-20,23-24,27-32,36,39-40,46-48,51-52,55-82H2,1-4H3,(H,95,96)(H,97,98)/b13-9-,14-10-,25-21-,26-22-,37-33-,38-34-,43-41-,44-42-,45-35-,53-49-,54-50-/t83-,84-,85-/m1/s1 Image of MNXM123703
SMILES (mnx)[CH3:1][CH2:5]/[CH:9]=[CH:13]\[CH2:17]/[CH:21]=[CH:25]\[CH2:29]/[CH:33]=[CH:37]\[CH2:39]/[CH:41]=[CH:43]\[CH2:47]/[CH:49]=[CH:53]\[CH2:57][CH2:61][CH2:65][CH2:69][CH2:73][C:86](=[O:91])[O:99][CH2:79][C@H:84]([CH2:81][O:103][P:107]([OH:95])(=[O:96])[O:101][CH2:77][C@H:83]([CH2:78][O:102][P:108]([OH:97])(=[O:98])[O:104][CH2:82][C@@H:85]([CH2:80][O:100][C:87]([CH2:74][CH2:70][CH2:66][CH2:62][CH2:58]/[CH:54]=[CH:50]\[CH2:48]/[CH:44]=[CH:42]\[CH2:40]/[CH:38]=[CH:34]\[CH2:30]/[CH:26]=[CH:22]\[CH2:18]/[CH:14]=[CH:10]\[CH2:6][CH3:2])=[O:92])[O:106][C:89]([CH2:76][CH2:72][CH2:68][CH2:64][CH2:60][CH2:56][CH2:52][CH2:46][CH2:36][CH2:32][CH2:28][CH2:24][CH2:20][CH2:16][CH2:12][CH2:8][CH3:4])=[O:94])[OH:90])[O:105][C:88]([CH2:75][CH2:71][CH2:67][CH2:63][CH2:59][CH2:55][CH2:51]/[CH:45]=[CH:35]\[CH2:31][CH2:27][CH2:23][CH2:19][CH2:15][CH2:11][CH2:7][CH3:3])=[O:93]
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:HMDB0059417
BOQCJUSBHWGLQU-FYNIRSDJSA-N 		CL(22:5(7Z,10Z,13Z,16Z,19Z)/18:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z))
(2S)-3-{[(2R)-3-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]-2-(octadecanoyloxy)propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy((2R)-3-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]-2-[(9Z)-octadec-9-enoyloxy]propoxy)phosphinic acid
1'-[1-(7Z,10Z,13Z,16Z,19Z-Docosapentaenoyl)-2-octadecanoyl-sn-glycero-3-phospho],3'-[1,2-di(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-rac-glycero-3-phospho]-glycerol
1'-[1-Docosapentaenoyl-2-stearoyl-sn-glycero-3-phospho],3'-[1,2-didocosapentaenoyl-rac-glycero-3-phospho]-glycerol
CL(1'-[22:5(7Z,10Z,13Z,16Z,19Z)/18:0],3'-[22:5(7Z,10Z,13Z,16Z,19Z)/22:5(7Z,10Z,13Z,16Z,19Z)])
CL(22:5/18:0/22:5/22:5)
CL(84:15)
Cardiolipin(22:5/18:0/22:5/22:5)
Cardiolipin(84:15)
[(2S)-3-({[(2R)-3-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]-2-(octadecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-3-[(7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoyloxy]-2-[(9Z)-octadec-9-enoyloxy]propoxy]phosphinic acid

SLM:000573108
slm:000573108
BOQCJUSBHWGLQU-FUPRIOEPSA-L 		Cardiolipin (22:5(7Z,10Z,13Z,16Z,19Z)/18:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z))
1'-[1-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-2-octadecanoyl-sn-glycero-3-phospho],3'-[1-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phospho]-glycerol
CL (22:5(7Z,10Z,13Z,16Z,19Z)/18:0/22:5(7Z,10Z,13Z,16Z,19Z)/18:1(9Z))

hmdb:HMDB59417 		secondary/obsolete/fantasy identifier