1-(8-[3]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol)

Properties Image MNX_ID MNXM29386 reference chebi:187687 formula C46H79O8P global charge 0 mol weight 791.104 InChIKey QIHVXBHEEVTVOD-GQSXMAELSA-N InChI InChI=1S/C46H79O8P/c47-27-33(48)28-53-55(49,50)54-30-34(52-24-12-8-4-2-6-10-14-32-16-18-40-42(26-32)46-38-22-20-36(38)44(40)46)29-51-23-11-7-3-1-5-9-13-31-15-17-39-41(25-31)45-37-21-19-35(37)43(39)45/h31-48H,1-30H2,(H,49,50)/t31?,32?,33-,34+,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45?,46?/m0/s1 SMILES O=P(O)(OC[C@@H](O)CO)OC[C@@H](COCCCCCCCCC1CCC2C(C1)C1C3CCC3C21)OCCCCCCCCC1CCC2C(C1)C1C3CCC3C21 MNX internals InChI (mnx) InChI=1/C46H79O8P/c47-27-33(48)28-53-55(49,50)54-30-34(52-24-12-8-4-2-6-10-14-32-16-18-40-42(26-32)46-38-22-20-36(38)44(40)46)29-51-23-11-7-3-1-5-9-13-31-15-17-39-41(25-31)45-37-21-19-35(37)43(39)45/h31-48H,1-30H2,(H,49,50)/t31?,32?,33-,34+,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45?,46?/m0/s1 SMILES (mnx) [CH2:1]([CH2:3][CH2:7][CH2:11][CH2:23][O:51][CH2:29][C@H:34]([CH2:30][O:54][P:55]([OH:49])(=[O:50])[O:53][CH2:28][C@H:33]([CH2:27][OH:47])[OH:48])[O:52][CH2:24][CH2:12][CH2:8][CH2:4][CH2:2][CH2:6][CH2:10][CH2:14][CH:32]1[CH2:16][CH2:18][CH:40]2[CH:42]([CH2:26]1)[CH:46]1[CH:38]3[CH2:22][CH2:20][CH:36]3[CH:44]21)[CH2:5][CH2:9][CH2:13][CH:31]1[CH2:15][CH2:17][CH:39]2[CH:41]([CH2:25]1)[CH:45]1[CH:37]3[CH2:21][CH2:19][CH:35]3[CH:43]21

Parent-child relations graph

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