| Properties | Image |
MNX_ID | MNXM345505 |
 |
reference | slm:000005599 |
formula | C34H61NO10P |
global charge | -1 |
mol weight | 674.833 |
InChIKey | GRAVOFJNHRXCNM-MKDWLBKRSA-M |
InChI | InChI=1S/C34H62NO10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24-26-33(37)45-30(28-43-46(40,41)44-29-31(35)34(38)39)27-42-32(36)25-23-21-19-10-8-6-4-2/h12-15,30-31H,3-11,16-29,35H2,1-2H3,(H,38,39)(H,40,41)/p-1/b13-12+,15-14-/t30-,31+/m1/s1 |
SMILES | CCCCCC/C=C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC)COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-] |
MNX internals
InChI (mnx) | InChI=1/C34H62NO10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24-26-33(37)45-30(28-43-46(40,41)44-29-31(35)34(38)39)27-42-32(36)25-23-21-19-10-8-6-4-2/h12-15,30-31H,3-11,16-29,35H2,1-2H3,(H,38,39)(H,40,41)/b13-12+,15-14-/t30-,31+/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:12]=[CH:13]/[CH:14]=[CH:15]\[CH2:16][CH2:17][CH2:18][CH2:20][CH2:22][CH2:24][CH2:26][C:33](=[O:37])[O:45][C@H:30]([CH2:27][O:42][C:32]([CH2:25][CH2:23][CH2:21][CH2:19][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:36])[CH2:28][O:43][P:46]([OH:40])(=[O:41])[O:44][CH2:29][C@@H:31]([C:34](=[O:38])[OH:39])[NH2:35] |
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