PAT16(26:1(2E)(2Me,4Me[S],6Me[S])/25:1(2E)(2Me,4Me[S],6Me[S])/25:1(2E)(2Me,4Me[S],6Me[S])/24:1(2E)(2Me,4Me[S],6Me[S]))

Properties Image MNX_ID MNXM68278 reference lipidmapsM:LMSL03000458 formula C142H264O16 global charge 0 mol weight 2227.658 InChIKey BNTPGKWQRHQYIB-RNVMZBBYSA-N InChI InChI=1S/C142H264O16/c1-18-23-28-33-38-43-48-53-57-61-65-69-74-78-83-88-93-98-103-118(8)108-122(12)112-126(16)139(149)156-134-131(145)129(115-151-137(147)124(14)110-120(10)106-116(6)101-96-91-86-81-76-72-67-63-59-55-50-45-40-35-30-25-20-3)153-142(136(134)154-130(144)105-100-95-90-85-80-71-52-47-42-37-32-27-22-5)158-141-135(157-140(150)127(17)113-123(13)109-119(9)104-99-94-89-84-79-75-70-66-62-58-54-49-44-39-34-29-24-19-2)132(146)133(128(114-143)152-141)155-138(148)125(15)111-121(11)107-117(7)102-97-92-87-82-77-73-68-64-60-56-51-46-41-36-31-26-21-4/h110-113,116-123,128-129,131-136,141-143,145-146H,18-109,114-115H2,1-17H3/b124-110+,125-111+,126-112+,127-113+/t116-,117-,118-,119-,120-,121-,122-,123-,128+,129+,131+,132-,133+,134-,135+,136+,141+,142+/m0/s1 SMILES CCCCCCCCCCCCCCCCCCCC[C@H](C)C[C@H](C)/C=C(\C)C(=O)O[C@H]1[C@@H](O[C@H]2O[C@H](COC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)CCCCCCCCCCCCCCCCCCC)[C@@H](O)[C@H](OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)CCCCCCCCCCCCCCCCCCCC)[C@H]2OC(=O)CCCCCCCCCCCCCCC)O[C@H](CO)[C@@H](OC(=O)/C(C)=C/[C@@H](C)C[C@@H](C)CCCCCCCCCCCCCCCCCCC)[C@@H]1O MNX internals InChI (mnx) InChI=1/C142H264O16/c1-18-23-28-33-38-43-48-53-57-61-65-69-74-78-83-88-93-98-103-118(8)108-122(12)112-126(16)139(149)156-134-131(145)129(115-151-137(147)124(14)110-120(10)106-116(6)101-96-91-86-81-76-72-67-63-59-55-50-45-40-35-30-25-20-3)153-142(136(134)154-130(144)105-100-95-90-85-80-71-52-47-42-37-32-27-22-5)158-141-135(157-140(150)127(17)113-123(13)109-119(9)104-99-94-89-84-79-75-70-66-62-58-54-49-44-39-34-29-24-19-2)132(146)133(128(114-143)152-141)155-138(148)125(15)111-121(11)107-117(7)102-97-92-87-82-77-73-68-64-60-56-51-46-41-36-31-26-21-4/h110-113,116-123,128-129,131-136,141-143,145-146H,18-109,114-115H2,1-17H3/b124-110+,125-111+,126-112+,127-113+/t116-,117-,118-,119-,120-,121-,122-,123-,128+,129+,131+,132-,133+,134-,135+,136+,141+,142+/m0/s1 SMILES (mnx) [CH3:1][CH2:18][CH2:23][CH2:28][CH2:33][CH2:38][CH2:43][CH2:48][CH2:53][CH2:57][CH2:61][CH2:65][CH2:69][CH2:74][CH2:78][CH2:83][CH2:88][CH2:93][CH2:98][CH2:103][C@H:118]([CH3:8])[CH2:108][C@H:122]([CH3:12])/[CH:112]=[C:126](\[CH3:16])[C:139](=[O:149])[O:156][C@H:134]1[C@H:131]([OH:145])[C@@H:129]([CH2:115][O:151][C:137](/[C:124]([CH3:14])=[CH:110]/[C@@H:120]([CH3:10])[CH2:106][C@@H:116]([CH3:6])[CH2:101][CH2:96][CH2:91][CH2:86][CH2:81][CH2:76][CH2:72][CH2:67][CH2:63][CH2:59][CH2:55][CH2:50][CH2:45][CH2:40][CH2:35][CH2:30][CH2:25][CH2:20][CH3:3])=[O:147])[O:153][C@H:142]([O:158][C@@H:141]2[C@H:135]([O:157][C:140](/[C:127]([CH3:17])=[CH:113]/[C@@H:123]([CH3:13])[CH2:109][C@@H:119]([CH3:9])[CH2:104][CH2:99][CH2:94][CH2:89][CH2:84][CH2:79][CH2:75][CH2:70][CH2:66][CH2:62][CH2:58][CH2:54][CH2:49][CH2:44][CH2:39][CH2:34][CH2:29][CH2:24][CH2:19][CH3:2])=[O:150])[C@@H:132]([OH:146])[C@H:133]([O:155][C:138](/[C:125]([CH3:15])=[CH:111]/[C@@H:121]([CH3:11])[CH2:107][C@@H:117]([CH3:7])[CH2:102][CH2:97][CH2:92][CH2:87][CH2:82][CH2:77][CH2:73][CH2:68][CH2:64][CH2:60][CH2:56][CH2:51][CH2:46][CH2:41][CH2:36][CH2:31][CH2:26][CH2:21][CH3:4])=[O:148])[C@@H:128]([CH2:114][OH:143])[O:152]2)[C@@H:136]1[O:154][C:130]([CH2:105][CH2:100][CH2:95][CH2:90][CH2:85][CH2:80][CH2:71][CH2:52][CH2:47][CH2:42][CH2:37][CH2:32][CH2:27][CH2:22][CH3:5])=[O:144]

Parent-child relations graph

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