| Properties | Image |
|---|
| MNX_ID | MNXM344918 |
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| reference | slm:000012667 |
| formula | C48H86NO8P |
| global charge | 0 |
| mol weight | 836.189 |
| InChIKey | BNTPVMJPLDUUCR-IMFLVAGHSA-N |
| InChI | InChI=1S/C48H86NO8P/c1-6-8-10-12-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-35-37-39-41-48(51)57-46(45-56-58(52,53)55-43-42-49(3,4)5)44-54-47(50)40-38-36-34-13-11-9-7-2/h14-15,17-18,20-21,23-24,26-27,46H,6-13,16,19,22,25,28-45H2,1-5H3/b15-14-,18-17-,21-20-,24-23-,27-26-/t46-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
MNX internals
| InChI (mnx) | InChI=1/C48H86NO8P/c1-6-8-10-12-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-35-37-39-41-48(51)57-46(45-56-58(52,53)55-43-42-49(3,4)5)44-54-47(50)40-38-36-34-13-11-9-7-2/h14-15,17-18,20-21,23-24,26-27,46H,6-13,16,19,22,25,28-45H2,1-5H3/b15-14-,18-17-,21-20-,24-23-,27-26-/t46-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:6][CH2:8][CH2:10][CH2:12]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][C:48](=[O:51])[O:57][C@H:46]([CH2:44][O:54][C:47]([CH2:40][CH2:38][CH2:36][CH2:34][CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:50])[CH2:45][O:56][P:58](=[O:52])([O-:53])[O:55][CH2:43][CH2:42][N+:49]([CH3:3])([CH3:4])[CH3:5] |
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