| Properties | Image |
| MNX_ID | MNXM1127897 |
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| reference | chebi:165934 |
| formula | C23H29N3O5 |
| global charge | 0 |
| mol weight | 427.501 |
| InChIKey | FGVFBDZSGQTYQX-UFYCRDLUSA-N |
| InChI | InChI=1S/C23H29N3O5/c1-14(2)20(23(30)31)26-22(29)19(13-15-6-4-3-5-7-15)25-21(28)18(24)12-16-8-10-17(27)11-9-16/h3-11,14,18-20,27H,12-13,24H2,1-2H3,(H,25,28)(H,26,29)(H,30,31)/t18-,19-,20-/m0/s1 |
| SMILES | CC(C)[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C23H29N3O5/c1-14(2)20(23(30)31)26-22(29)19(13-15-6-4-3-5-7-15)25-21(28)18(24)12-16-8-10-17(27)11-9-16/h3-11,14,18-20,27H,12-13,24H2,1-2H3,(H,25,28)(H,26,29)(H,30,31)/t18-,19-,20-/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH:14]([CH3:2])[C@@H:20]([C:23](=[O:30])[OH:31])[N:26]=[C:22]([C@H:19]([CH2:13][C:15]1=[CH:6][CH:4]=[CH:3][CH:5]=[CH:7]1)[N:25]=[C:21]([C@H:18]([CH2:12][C:16]1=[CH:9][CH:11]=[C:17]([OH:27])[CH:10]=[CH:8]1)[NH2:24])[OH:28])[OH:29] |
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