PAT18(25:1(2E)(2Me,4Me[S],6Me[S])/24:1(2E)(2Me,4Me[S],6Me[S])/22:1(2E)(2Me,4Me[S],6Me[S])/24:1(2E)(2Me,4Me[S],6Me[S]))

Properties Image MNX_ID MNXM68738 reference lipidmapsM:LMSL03000923 formula C140H260O16 global charge 0 mol weight 2199.604 InChIKey RGIRLBDEARQHOE-FDSFTNGDSA-N InChI InChI=1S/C140H260O16/c1-18-23-28-33-38-43-48-53-58-62-67-71-76-81-85-90-95-100-115(7)105-119(11)109-123(15)136(146)153-131-126(112-141)150-139(133(130(131)144)155-138(148)125(17)111-121(13)107-117(9)102-97-92-87-80-75-70-66-61-56-51-46-41-36-31-26-21-4)156-140-134(152-128(142)103-98-93-88-83-78-73-64-57-52-47-42-37-32-27-22-5)132(154-137(147)124(16)110-120(12)106-116(8)101-96-91-86-82-77-72-68-63-59-54-49-44-39-34-29-24-19-2)129(143)127(151-140)113-149-135(145)122(14)108-118(10)104-114(6)99-94-89-84-79-74-69-65-60-55-50-45-40-35-30-25-20-3/h108-111,114-121,126-127,129-134,139-141,143-144H,18-107,112-113H2,1-17H3/b122-108+,123-109+,124-110+,125-111+/t114-,115-,116-,117-,118-,119-,120-,121-,126+,127+,129+,130-,131+,132-,133+,134+,139+,140+/m0/s1 SMILES CCCCCCCCCCCCCCCCCCC[C@H](C)C[C@H](C)/C=C(\C)C(=O)O[C@H]1[C@H](O)[C@@H](COC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)CCCCCCCCCCCCCCCCCC)O[C@H](O[C@H]2O[C@H](CO)[C@@H](OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)CCCCCCCCCCCCCCCCCCC)[C@H](O)[C@H]2OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)CCCCCCCCCCCCCCCCCC)[C@@H]1OC(=O)CCCCCCCCCCCCCCCCC MNX internals InChI (mnx) InChI=1/C140H260O16/c1-18-23-28-33-38-43-48-53-58-62-67-71-76-81-85-90-95-100-115(7)105-119(11)109-123(15)136(146)153-131-126(112-141)150-139(133(130(131)144)155-138(148)125(17)111-121(13)107-117(9)102-97-92-87-80-75-70-66-61-56-51-46-41-36-31-26-21-4)156-140-134(152-128(142)103-98-93-88-83-78-73-64-57-52-47-42-37-32-27-22-5)132(154-137(147)124(16)110-120(12)106-116(8)101-96-91-86-82-77-72-68-63-59-54-49-44-39-34-29-24-19-2)129(143)127(151-140)113-149-135(145)122(14)108-118(10)104-114(6)99-94-89-84-79-74-69-65-60-55-50-45-40-35-30-25-20-3/h108-111,114-121,126-127,129-134,139-141,143-144H,18-107,112-113H2,1-17H3/b122-108+,123-109+,124-110+,125-111+/t114-,115-,116-,117-,118-,119-,120-,121-,126+,127+,129+,130-,131+,132-,133+,134+,139+,140+/m0/s1 SMILES (mnx) [CH3:1][CH2:18][CH2:23][CH2:28][CH2:33][CH2:38][CH2:43][CH2:48][CH2:53][CH2:58][CH2:62][CH2:67][CH2:71][CH2:76][CH2:81][CH2:85][CH2:90][CH2:95][CH2:100][C@H:115]([CH3:7])[CH2:105][C@H:119]([CH3:11])/[CH:109]=[C:123](\[CH3:15])[C:136](=[O:146])[O:153][C@@H:131]1[C@@H:126]([CH2:112][OH:141])[O:150][C@H:139]([O:156][C@@H:140]2[C@H:134]([O:152][C:128]([CH2:103][CH2:98][CH2:93][CH2:88][CH2:83][CH2:78][CH2:73][CH2:64][CH2:57][CH2:52][CH2:47][CH2:42][CH2:37][CH2:32][CH2:27][CH2:22][CH3:5])=[O:142])[C@@H:132]([O:154][C:137](/[C:124]([CH3:16])=[CH:110]/[C@@H:120]([CH3:12])[CH2:106][C@@H:116]([CH3:8])[CH2:101][CH2:96][CH2:91][CH2:86][CH2:82][CH2:77][CH2:72][CH2:68][CH2:63][CH2:59][CH2:54][CH2:49][CH2:44][CH2:39][CH2:34][CH2:29][CH2:24][CH2:19][CH3:2])=[O:147])[C@H:129]([OH:143])[C@@H:127]([CH2:113][O:149][C:135](/[C:122]([CH3:14])=[CH:108]/[C@@H:118]([CH3:10])[CH2:104][C@@H:114]([CH3:6])[CH2:99][CH2:94][CH2:89][CH2:84][CH2:79][CH2:74][CH2:69][CH2:65][CH2:60][CH2:55][CH2:50][CH2:45][CH2:40][CH2:35][CH2:30][CH2:25][CH2:20][CH3:3])=[O:145])[O:151]2)[C@H:133]([O:155][C:138](/[C:125]([CH3:17])=[CH:111]/[C@@H:121]([CH3:13])[CH2:107][C@@H:117]([CH3:9])[CH2:102][CH2:97][CH2:92][CH2:87][CH2:80][CH2:75][CH2:70][CH2:66][CH2:61][CH2:56][CH2:51][CH2:46][CH2:41][CH2:36][CH2:31][CH2:26][CH2:21][CH3:4])=[O:148])[C@H:130]1[OH:144]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0