| Properties | Image |
| MNX_ID | MNXM170491 |
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| reference | chebi:129179 |
| formula | C26H33N3O4S |
| global charge | 0 |
| mol weight | 483.634 |
| InChIKey | YZYJXWPDYMJSBS-BJKOFHAPSA-N |
| InChI | InChI=1S/C26H33N3O4S/c30-16-23-24(21-12-6-2-7-13-21)26(29(23)34(32,33)17-20-10-4-1-5-11-20)18-28(19-26)25(31)27-22-14-8-3-9-15-22/h1-2,4-7,10-13,22-24,30H,3,8-9,14-19H2,(H,27,31)/t23-,24+/m0/s1 |
| SMILES | O=C(NC1CCCCC1)N1CC2(C1)[C@H](C1=CC=CC=C1)[C@H](CO)N2S(=O)(=O)CC1=CC=CC=C1 |
MNX internals
| InChI (mnx) | InChI=1/C26H33N3O4S/c30-16-23-24(21-12-6-2-7-13-21)26(29(23)34(32,33)17-20-10-4-1-5-11-20)18-28(19-26)25(31)27-22-14-8-3-9-15-22/h1-2,4-7,10-13,22-24,30H,3,8-9,14-19H2,(H,27,31)/t23-,24+/m0/s1 |
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| SMILES (mnx) | [CH:1]1=[CH:4][CH:10]=[C:20]([CH2:17][S:34]([N:29]2[C@@H:23]([CH2:16][OH:30])[C@@H:24]([C:21]3=[CH:12][CH:6]=[CH:2][CH:7]=[CH:13]3)[C:26]23[CH2:18][N:28]([C:25](=[N:27][CH:22]2[CH2:14][CH2:8][CH2:3][CH2:9][CH2:15]2)[OH:31])[CH2:19]3)(=[O:32])=[O:33])[CH:11]=[CH:5]1 |
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