Feedback
(R)-3-Hydroxyhexanoyl-[acyl-carrier protein]
MNXM25370 is deprecated and here replaced by MNXM733048
!!! Alternative mappings exist !!!
| Properties | Image |
|---|
| MNX_ID | MNXM733048 |
 |
| reference | biggM:3hhexACP |
| formula | C17H31N2O9PS* |
| global charge | -1 |
| mol weight | |
| InChIKey | |
| InChI | |
| SMILES | [*]OP(=O)([O-])OCC(C)(C)C(O)C(=O)NCCC(=O)NCCSC(=O)CC(O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C18H35N2O9PS/c1-5-6-13(21)11-15(23)31-10-9-19-14(22)7-8-20-17(25)16(24)18(2,3)12-29-30(26,27)28-4/h13,16,21,24H,5-12H2,1-4H3,(H,19,22)(H,20,25)(H,26,27)/t13?,16?/i4+1 |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH2:6][CH:13]([CH2:11][C:15](=[O:23])[S:31][CH2:10][CH2:9][N:19]=[C:14]([CH2:7][CH2:8][N:20]=[C:17]([CH:16]([C:18]([CH3:2])([CH3:3])[CH2:12][O:29][P:30]([OH:26])(=[O:27])[O:28][13CH3:4])[OH:24])[OH:25])[OH:22])[OH:21] |
|
| Parent-child relations graph |
| Occurences in reactions | #reac |
|---|
| in my sandbox |
0 |
| in MNXref (generic) | 3 |
| in models (compartimentalized) |
5 |
|
Similar chemical compounds in external resources
| Identifier | Description |
|---|
bigg.metabolite:3hhexACP
biggM:3hhexACP
| (R)-3-Hydroxyhexanoyl-[acyl-carrier protein]
|
biggM:M_3hhexACP
| secondary/obsolete/fantasy identifier
|