| Properties | Image |
MNX_ID | MNXM192573 |
 |
reference | slm:000001569 |
formula | C30H55NO10P |
global charge | -1 |
mol weight | 620.741 |
InChIKey | UAYZVZKMTGBJQN-DTVLNYDZSA-M |
InChI | InChI=1S/C30H56NO10P/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-21-28(32)38-23-26(41-29(33)22-19-6-4-2)24-39-42(36,37)40-25-27(31)30(34)35/h10-11,26-27H,3-9,12-25,31H2,1-2H3,(H,34,35)(H,36,37)/p-1/b11-10+/t26-,27+/m1/s1 |
SMILES | CCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CCCCC |
MNX internals
InChI (mnx) | InChI=1/C30H56NO10P/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20-21-28(32)38-23-26(41-29(33)22-19-6-4-2)24-39-42(36,37)40-25-27(31)30(34)35/h10-11,26-27H,3-9,12-25,31H2,1-2H3,(H,34,35)(H,36,37)/b11-10+/t26-,27+/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:8][CH2:9]/[CH:10]=[CH:11]/[CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:20][CH2:21][C:28](=[O:32])[O:38][CH2:23][C@H:26]([CH2:24][O:39][P:42]([OH:36])(=[O:37])[O:40][CH2:25][C@@H:27]([C:30](=[O:34])[OH:35])[NH2:31])[O:41][C:29]([CH2:22][CH2:19][CH2:6][CH2:4][CH3:2])=[O:33] |
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