| Properties | Image |
MNX_ID | MNXM343376 |
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reference | slm:000005481 |
formula | C38H63NO10P |
global charge | -1 |
mol weight | 724.893 |
InChIKey | SSCVNLGLHPRICI-OEVQNYADSA-M |
InChI | InChI=1S/C38H64NO10P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30-37(41)49-34(31-46-36(40)29-4-2)32-47-50(44,45)48-33-35(39)38(42)43/h8-9,11-12,14-15,17-18,20-21,34-35H,3-7,10,13,16,19,22-33,39H2,1-2H3,(H,42,43)(H,44,45)/p-1/b9-8-,12-11-,15-14-,18-17-,21-20-/t34-,35+/m1/s1 |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-] |
MNX internals
InChI (mnx) | InChI=1/C38H64NO10P/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30-37(41)49-34(31-46-36(40)29-4-2)32-47-50(44,45)48-33-35(39)38(42)43/h8-9,11-12,14-15,17-18,20-21,34-35H,3-7,10,13,16,19,22-33,39H2,1-2H3,(H,42,43)(H,44,45)/b9-8-,12-11-,15-14-,18-17-,21-20-/t34-,35+/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:6][CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][C:37](=[O:41])[O:49][C@H:34]([CH2:31][O:46][C:36]([CH2:29][CH2:4][CH3:2])=[O:40])[CH2:32][O:47][P:50]([OH:44])(=[O:45])[O:48][CH2:33][C@@H:35]([C:38](=[O:42])[OH:43])[NH2:39] |
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