| Properties | Image |
|---|
| MNX_ID | MNXM1194865 |
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| reference | envipathM:...cf3ce0b26810 |
| formula | C14H16NO8S |
| global charge | -1 |
| mol weight | 358.348 |
| InChIKey | FRBVLBPMQXBBAK-UHFFFAOYSA-M |
| InChI | InChI=1S/C14H17NO8S/c16-7-2-1-3-8(17)11(7)24-15-12(20)6(10(19)13(15)21)4-5-9(18)14(22)23/h6-8,11,16-17H,1-5H2,(H,22,23)/p-1 |
| SMILES | O=C([O-])C(=O)CCC1C(=O)C(=O)N(SC2C(O)CCCC2O)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C14H17NO8S/c16-7-2-1-3-8(17)11(7)24-15-12(20)6(10(19)13(15)21)4-5-9(18)14(22)23/h6-8,11,16-17H,1-5H2,(H,22,23)/t6?,7?,8?,11? |
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| SMILES (mnx) | [CH2:1]1[CH2:2][CH:7]([OH:16])[CH:11]([S:24][N:15]2[C:12](=[O:20])[CH:6]([CH2:4][CH2:5][C:9]([C:14]([OH:22])=[O:23])=[O:18])[C:10](=[O:19])[C:13]2=[O:21])[CH:8]([OH:17])[CH2:3]1 |
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