| Properties | Image |
MNX_ID | MNXM90476 |
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reference | chebi:74589 |
formula | C18H28NO18P2*3 |
global charge | -2 |
mol weight | |
InChIKey | |
InChI | |
SMILES | [*][C@@H]1O[C@H](COP(=O)([O-])O[C@H]2[C@@H](O)[C@H]([*])O[C@@H]2COP(=O)([O-])O[C@H]2[C@@H](O)[C@H]([*])O[C@@H]2CO)[C@@H](OC(=O)[C@@H](N)CO)[C@H]1O |
MNX internals
InChI (mnx) | InChI=1/C21H39NO18P2/c1-8-15(25)18(38-21(28)11(22)4-23)13(36-8)6-33-42(31,32)40-20-14(37-10(3)17(20)27)7-34-41(29,30)39-19-12(5-24)35-9(2)16(19)26/h8-20,23-27H,4-7,22H2,1-3H3,(H,29,30)(H,31,32)/t8-,9-,10-,11-,12+,13+,14+,15-,16-,17-,18+,19+,20+/m0/s1/i1+1,2+1,3+1 |
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SMILES (mnx) | [13CH3:1][C@H:8]1[C@H:15]([OH:25])[C@H:18]([O:38][C:21]([C@H:11]([CH2:4][OH:23])[NH2:22])=[O:28])[C@@H:13]([CH2:6][O:33][P:42]([OH:31])(=[O:32])[O:40][C@@H:20]2[C@@H:14]([CH2:7][O:34][P:41]([OH:29])(=[O:30])[O:39][C@@H:19]3[C@@H:12]([CH2:5][OH:24])[O:35][C@@H:9]([13CH3:2])[C@@H:16]3[OH:26])[O:37][C@@H:10]([13CH3:3])[C@@H:17]2[OH:27])[O:36]1 |
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