| Properties | Image |
MNX_ID | MNXM731817 |
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reference | biggM:rhcys |
formula | C9H17NO6S |
global charge | 0 |
mol weight | 267.303 |
InChIKey | LQBYCHHWIZJWRE-UHFFFAOYSA-N |
InChI | InChI=1S/C9H17NO6S/c10-4(8(14)15)1-2-17-9-7(13)6(12)5(3-11)16-9/h4-7,9,11-13H,1-3,10H2,(H,14,15) |
SMILES | [NH3+]C(CCSC1OC(CO)C(O)C1O)C(=O)[O-] |
MNX internals
InChI (mnx) | InChI=1/C9H17NO6S/c10-4(8(14)15)1-2-17-9-7(13)6(12)5(3-11)16-9/h4-7,9,11-13H,1-3,10H2,(H,14,15)/t4?,5?,6?,7?,9? |
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SMILES (mnx) | [CH2:1]([CH2:2][S:17][CH:9]1[CH:7]([OH:13])[CH:6]([OH:12])[CH:5]([CH2:3][OH:11])[O:16]1)[CH:4]([C:8](=[O:14])[OH:15])[NH2:10] |
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