CL(a-13:0/i-17:0/a-13:0/i-19:0)[rac]

Properties Image MNX_ID MNXM1109313 reference hmdb:HMDB0079514 formula C71H138O17P2 global charge 0 mol weight 1325.816 InChIKey QSIROCSPWDREPE-VKIXXVAZSA-N InChI InChI=1S/C71H138O17P2/c1-9-63(7)49-41-33-27-29-35-43-51-68(73)81-57-66(87-70(75)53-45-37-25-21-17-13-11-12-15-19-23-31-39-47-61(3)4)59-85-89(77,78)83-55-65(72)56-84-90(79,80)86-60-67(58-82-69(74)52-44-36-30-28-34-42-50-64(8)10-2)88-71(76)54-46-38-26-22-18-14-16-20-24-32-40-48-62(5)6/h61-67,72H,9-60H2,1-8H3,(H,77,78)(H,79,80)/t63?,64?,65-,66-,67-/m1/s1 SMILES CCC(C)CCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@@H](O)COP(=O)(O)OC[C@@H](COC(=O)CCCCCCCCC(C)CC)OC(=O)CCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCC(C)C MNX internals InChI (mnx) InChI=1/C71H138O17P2/c1-9-63(7)49-41-33-27-29-35-43-51-68(73)81-57-66(87-70(75)53-45-37-25-21-17-13-11-12-15-19-23-31-39-47-61(3)4)59-85-89(77,78)83-55-65(72)56-84-90(79,80)86-60-67(58-82-69(74)52-44-36-30-28-34-42-50-64(8)10-2)88-71(76)54-46-38-26-22-18-14-16-20-24-32-40-48-62(5)6/h61-67,72H,9-60H2,1-8H3,(H,77,78)(H,79,80)/t63?,64?,65-,66-,67-/m1/s1 SMILES (mnx) [CH3:1][CH2:9][CH:63]([CH3:7])[CH2:49][CH2:41][CH2:33][CH2:27][CH2:29][CH2:35][CH2:43][CH2:51][C:68](=[O:73])[O:81][CH2:57][C@H:66]([CH2:59][O:85][P:89]([OH:77])(=[O:78])[O:83][CH2:55][C@H:65]([CH2:56][O:84][P:90]([OH:79])(=[O:80])[O:86][CH2:60][C@@H:67]([CH2:58][O:82][C:69]([CH2:52][CH2:44][CH2:36][CH2:30][CH2:28][CH2:34][CH2:42][CH2:50][CH:64]([CH3:8])[CH2:10][CH3:2])=[O:74])[O:88][C:71]([CH2:54][CH2:46][CH2:38][CH2:26][CH2:22][CH2:18][CH2:14][CH2:16][CH2:20][CH2:24][CH2:32][CH2:40][CH2:48][CH:62]([CH3:5])[CH3:6])=[O:76])[OH:72])[O:87][C:70]([CH2:53][CH2:45][CH2:37][CH2:25][CH2:21][CH2:17][CH2:13][CH2:11][CH2:12][CH2:15][CH2:19][CH2:23][CH2:31][CH2:39][CH2:47][CH:61]([CH3:3])[CH3:4])=[O:75]

Parent-child relations graph

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