| Properties | Image |
MNX_ID | MNXM166205 |
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reference | sabiorkM:27887 |
formula | C10H18N2O3S |
global charge | 0 |
mol weight | 246.332 |
InChIKey | JJKLFBMLMYQLKN-RRQHEKLDSA-N |
InChI | InChI=1S/C10H18N2O3S/c1-6(16)8(11)9(13)12-5-3-2-4-7(12)10(14)15/h6-8,16H,2-5,11H2,1H3,(H,14,15)/t6?,7?,8-/m0/s1 |
SMILES | CC(S)[C@H](N)C(=O)N1CCCCC1C(=O)O |
MNX internals
InChI (mnx) | InChI=1/C10H18N2O3S/c1-6(16)8(11)9(13)12-5-3-2-4-7(12)10(14)15/h6-8,16H,2-5,11H2,1H3,(H,14,15)/t6?,7?,8-/m0/s1 |
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SMILES (mnx) | [CH3:1][CH:6]([C@@H:8]([C:9]([N:12]1[CH2:5][CH2:3][CH2:2][CH2:4][CH:7]1[C:10](=[O:14])[OH:15])=[O:13])[NH2:11])[SH:16] |
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