PS(DiMe(11,5)/DiMe(11,5))

Properties Image MNX_ID MNXM160582 reference hmdb:HMDB0061562 formula C50H86NO12P global charge 0 mol weight 924.207 InChIKey YCHYDGKEWUDMSP-UHFFFAOYSA-N InChI InChI=1S/C50H86NO12P/c1-7-9-23-29-44-38(3)40(5)46(62-44)31-25-19-15-11-13-17-21-27-33-48(52)58-35-42(36-59-64(56,57)60-37-43(51)50(54)55)61-49(53)34-28-22-18-14-12-16-20-26-32-47-41(6)39(4)45(63-47)30-24-10-8-2/h42-43H,7-37,51H2,1-6H3,(H,54,55)(H,56,57) SMILES CCCCCC1=C(C)C(C)=C(CCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC(N)C(=O)O)OC(=O)CCCCCCCCCCC2=C(C)C(C)=C(CCCCC)O2)O1 MNX internals InChI (mnx) InChI=1/C50H86NO12P/c1-7-9-23-29-44-38(3)40(5)46(62-44)31-25-19-15-11-13-17-21-27-33-48(52)58-35-42(36-59-64(56,57)60-37-43(51)50(54)55)61-49(53)34-28-22-18-14-12-16-20-26-32-47-41(6)39(4)45(63-47)30-24-10-8-2/h42-43H,7-37,51H2,1-6H3,(H,54,55)(H,56,57)/t42?,43? SMILES (mnx) [CH3:1][CH2:7][CH2:9][CH2:23][CH2:29][C:44]1=[C:38]([CH3:3])[C:40]([CH3:5])=[C:46]([CH2:31][CH2:25][CH2:19][CH2:15][CH2:11][CH2:13][CH2:17][CH2:21][CH2:27][CH2:33][C:48](=[O:52])[O:58][CH2:35][CH:42]([CH2:36][O:59][P:64]([OH:56])(=[O:57])[O:60][CH2:37][CH:43]([C:50](=[O:54])[OH:55])[NH2:51])[O:61][C:49]([CH2:34][CH2:28][CH2:22][CH2:18][CH2:14][CH2:12][CH2:16][CH2:20][CH2:26][CH2:32][C:47]2=[C:41]([CH3:6])[C:39]([CH3:4])=[C:45]([CH2:30][CH2:24][CH2:10][CH2:8][CH3:2])[O:63]2)=[O:53])[O:62]1

Parent-child relations graph

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