| Properties | Image |
|---|
| MNX_ID | MNXM101517 |
 |
| reference | chebi:67507 |
| formula | C27H32N2O10 |
| global charge | 0 |
| mol weight | 544.557 |
| InChIKey | ZXOASSJPZSDCOJ-JDVSSZFKSA-N |
| InChI | InChI=1S/C27H32N2O10/c1-34-3-2-11-7-29-15-6-27-18(29)4-12(11)13(15)9-35-26(27)28-14-5-16-23(37-10-36-16)24(19(14)27)39-25-22(33)21(32)20(31)17(8-30)38-25/h2,5,12-13,15,17-18,20-22,25,30-33H,3-4,6-10H2,1H3/b11-2+/t12-,13-,15-,17+,18-,20+,21-,22+,25-,27-/m0/s1 |
| SMILES | COC/C=C1\CN2[C@H]3C[C@@H]1[C@@H]1COC4=NC5=CC6=C(OCO6)C(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)=C5[C@@]43C[C@@H]12 |
MNX internals
| InChI (mnx) | InChI=1/C27H32N2O10/c1-34-3-2-11-7-29-15-6-27-18(29)4-12(11)13(15)9-35-26(27)28-14-5-16-23(37-10-36-16)24(19(14)27)39-25-22(33)21(32)20(31)17(8-30)38-25/h2,5,12-13,15,17-18,20-22,25,30-33H,3-4,6-10H2,1H3/b11-2+/t12-,13-,15-,17+,18-,20+,21-,22+,25-,27-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][O:34][CH2:3]/[CH:2]=[C:11]1\[CH2:7][N:29]2[C@H:15]3[CH2:6][C@@:27]45[C@@H:18]2[CH2:4][C@@H:12]1[C@@H:13]3[CH2:9][O:35][C:26]4=[N:28][C:14]1=[CH:5][C:16]2=[C:23]([C:24]([O:39][C@H:25]3[C@H:22]([OH:33])[C@@H:21]([OH:32])[C@H:20]([OH:31])[C@@H:17]([CH2:8][OH:30])[O:38]3)=[C:19]15)[O:37][CH2:10][O:36]2 |
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