| Properties | Image |
|---|
| MNX_ID | MNXM1133029 |
 |
| reference | sabiorkM:31535 |
| formula | C17H31AsN2O15S |
| global charge | 0 |
| mol weight | 610.423 |
| InChIKey | UFFVRAZTLALLGR-MGQAWMCHSA-N |
| InChI | InChI=1S/C17H31AsN2O15S/c1-4(22)19-5(3-36-18(31,32)33)16(30)20-7-9(24)8(23)6(2-21)34-17(7)35-15-13(28)11(26)10(25)12(27)14(15)29/h5-15,17,21,23-29H,2-3H2,1H3,(H,19,22)(H,20,30)(H2,31,32,33)/t5-,6+,7+,8+,9+,10?,11-,12+,13+,14+,15?,17+/m0/s1 |
| SMILES | CC(O)=N[C@@H](CS[As](=O)(O)O)C(O)=N[C@H]1[C@@H](OC2[C@H](O)[C@H](O)C(O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C17H31AsN2O15S/c1-4(22)19-5(3-36-18(31,32)33)16(30)20-7-9(24)8(23)6(2-21)34-17(7)35-15-13(28)11(26)10(25)12(27)14(15)29/h5-15,17,21,23-29H,2-3H2,1H3,(H,19,22)(H,20,30)(H2,31,32,33)/t5-,6+,7+,8+,9+,10?,11-,12+,13+,14+,15?,17+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:4](=[N:19][C@@H:5]([CH2:3][S:36][As:18]([OH:31])([OH:32])=[O:33])[C:16](=[N:20][C@@H:7]1[C@@H:9]([OH:24])[C@H:8]([OH:23])[C@@H:6]([CH2:2][OH:21])[O:34][C@@H:17]1[O:35][CH:15]1[C@H:13]([OH:28])[C@@H:11]([OH:26])[CH:10]([OH:25])[C@@H:12]([OH:27])[C@H:14]1[OH:29])[OH:30])[OH:22] |
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