| Properties | Image |
|---|
| MNX_ID | MNXM225534 |
 |
| reference | slm:000002532 |
| formula | C60H95NO10P |
| global charge | -1 |
| mol weight | 1021.391 |
| InChIKey | GCBCRRKIFNWCKH-JNEXTJKVSA-M |
| InChI | InChI=1S/C60H96NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-34-35-37-39-41-43-45-47-49-51-58(62)68-53-56(54-69-72(66,67)70-55-57(61)60(64)65)71-59(63)52-50-48-46-44-42-40-38-36-33-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-24,26-27,29-30,33,36,40,42,46,48,56-57H,3-4,6,8-10,15-16,21-22,25,28,31-32,34-35,37-39,41,43-45,47,49-55,61H2,1-2H3,(H,64,65)(H,66,67)/p-1/b7-5-,13-11-,14-12-,19-17-,20-18-,24-23-,27-26-,30-29-,36-33-,42-40-,48-46-/t56-,57+/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C60H96NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-34-35-37-39-41-43-45-47-49-51-58(62)68-53-56(54-69-72(66,67)70-55-57(61)60(64)65)71-59(63)52-50-48-46-44-42-40-38-36-33-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-24,26-27,29-30,33,36,40,42,46,48,56-57H,3-4,6,8-10,15-16,21-22,25,28,31-32,34-35,37-39,41,43-45,47,49-55,61H2,1-2H3,(H,64,65)(H,66,67)/b7-5-,13-11-,14-12-,19-17-,20-18-,24-23-,27-26-,30-29-,36-33-,42-40-,48-46-/t56-,57+/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:31][CH2:32][CH2:34][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][C:58](=[O:62])[O:68][CH2:53][C@H:56]([CH2:54][O:69][P:72]([OH:66])(=[O:67])[O:70][CH2:55][C@@H:57]([C:60](=[O:64])[OH:65])[NH2:61])[O:71][C:59]([CH2:52][CH2:50]/[CH:48]=[CH:46]\[CH2:44]/[CH:42]=[CH:40]\[CH2:38]/[CH:36]=[CH:33]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:63] |
|