| Properties | Image |
| MNX_ID | MNXM744636 |
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| reference | biggM:argvalcys |
| formula | C14H29N6O4S |
| global charge | 1 |
| mol weight | 377.491 |
| InChIKey | FTMRPIVPSDVGCC-BBBLOLIVSA-O |
| InChI | InChI=1S/C14H28N6O4S/c1-7(2)10(12(22)19-9(6-25)13(23)24)20-11(21)8(15)4-3-5-18-14(16)17/h7-10,25H,3-6,15H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)(H4,16,17,18)/p+1/t8-,9-,10+/m1/s1 |
| SMILES | CC(C)[C@H](NC(=O)[C@H](N)CCCNC(N)=[NH2+])C(=O)N[C@H](CS)C(=O)O |
MNX internals
| InChI (mnx) | InChI=1/C14H28N6O4S/c1-7(2)10(12(22)19-9(6-25)13(23)24)20-11(21)8(15)4-3-5-18-14(16)17/h7-10,25H,3-6,15H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)(H4,16,17,18)/t8-,9-,10+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH:7]([CH3:2])[C@@H:10]([C:12](=[N:19][C@H:9]([CH2:6][SH:25])[C:13](=[O:23])[OH:24])[OH:22])[N:20]=[C:11]([C@@H:8]([CH2:4][CH2:3][CH2:5][NH:18][C:14](=[NH:16])[NH2:17])[NH2:15])[OH:21] |
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