| Properties | Image |
|---|
| MNX_ID | MNXM1398854 |
 |
| reference | chebi:217170 |
| formula | C24H32Cl5NO5S |
| global charge | 0 |
| mol weight | 623.854 |
| InChIKey | RGMRJERYAWLGFL-BDJRNXFDSA-N |
| InChI | InChI=1S/C24H32Cl5NO5S/c1-4-13(25)7-14(26)5-6-17-23(35-17)20(29)19(28)15(27)8-18-11(2)22(34-10-33-18)21(32)24-30-16(9-36-24)12(3)31/h5-6,9,11,13-15,17-23,32H,4,7-8,10H2,1-3H3/b6-5-/t11?,13?,14?,15?,17-,18?,19?,20?,21?,22-,23+/m1/s1 |
| SMILES | CCC(Cl)CC(Cl)/C=C\[C@H]1O[C@@H]1C(Cl)C(Cl)C(Cl)CC1OCO[C@@H](C(O)C2=NC(C(C)=O)=CS2)C1C |
MNX internals
| InChI (mnx) | InChI=1/C24H32Cl5NO5S/c1-4-13(25)7-14(26)5-6-17-23(35-17)20(29)19(28)15(27)8-18-11(2)22(34-10-33-18)21(32)24-30-16(9-36-24)12(3)31/h5-6,9,11,13-15,17-23,32H,4,7-8,10H2,1-3H3/b6-5-/t11?,13?,14?,15?,17-,18?,19?,20?,21?,22-,23+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH:13]([CH2:7][CH:14](/[CH:5]=[CH:6]\[C@@H:17]1[C@@H:23]([CH:20]([CH:19]([CH:15]([CH2:8][CH:18]2[CH:11]([CH3:2])[C@H:22]([CH:21]([C:24]3=[N:30][C:16]([C:12]([CH3:3])=[O:31])=[CH:9][S:36]3)[OH:32])[O:34][CH2:10][O:33]2)[Cl:27])[Cl:28])[Cl:29])[O:35]1)[Cl:26])[Cl:25] |
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