| Properties | Image |
|---|
| MNX_ID | MNXM1178509 |
 |
| reference | envipathM:...eb5732ca9a09 |
| formula | C37H66NO15 |
| global charge | -1 |
| mol weight | 764.927 |
| InChIKey | QLSUKRIECZGQOS-YANIPKKJSA-M |
| InChI | InChI=1S/C37H67NO15/c1-14-25(40)19(2)15-34(8,45)30(52-27-18-37(47,38(11)12)16-20(3)49-27)21(4)28(51-26-17-35(9,48-13)29(41)24(7)50-26)22(5)32(42)53-31(23(6)39)36(10,46)33(43)44/h19-24,26-31,39,41,45-47H,14-18H2,1-13H3,(H,43,44)/p-1/t19-,20-,21+,22-,23?,24+,26+,27+,28+,29+,30-,31-,34-,35-,36-,37-/m1/s1 |
| SMILES | CCC(=O)[C@H](C)C[C@@](C)(O)[C@H](O[C@H]1C[C@@](O)(N(C)C)C[C@@H](C)O1)[C@@H](C)[C@H](O[C@H]1C[C@@](C)(OC)[C@@H](O)[C@H](C)O1)[C@@H](C)C(=O)O[C@H](C(C)O)[C@@](C)(O)C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C37H67NO15/c1-14-25(40)19(2)15-34(8,45)30(52-27-18-37(47,38(11)12)16-20(3)49-27)21(4)28(51-26-17-35(9,48-13)29(41)24(7)50-26)22(5)32(42)53-31(23(6)39)36(10,46)33(43)44/h19-24,26-31,39,41,45-47H,14-18H2,1-13H3,(H,43,44)/t19-,20-,21+,22-,23?,24+,26+,27+,28+,29+,30-,31-,34-,35-,36-,37-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:14][C:25]([C@H:19]([CH3:2])[CH2:15][C@:34]([CH3:8])([C@@H:30]([C@@H:21]([CH3:4])[C@@H:28]([C@@H:22]([CH3:5])[C:32](=[O:42])[O:53][C@H:31]([CH:23]([CH3:6])[OH:39])[C@:36]([CH3:10])([C:33](=[O:43])[OH:44])[OH:46])[O:51][C@H:26]1[CH2:17][C@@:35]([CH3:9])([O:48][CH3:13])[C@@H:29]([OH:41])[C@H:24]([CH3:7])[O:50]1)[O:52][C@H:27]1[CH2:18][C@:37]([N:38]([CH3:11])[CH3:12])([OH:47])[CH2:16][C@@H:20]([CH3:3])[O:49]1)[OH:45])=[O:40] |
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