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(3S,4S,5R)-Hexane-1,2,3,4,5,6-hexol
MNXM615 is deprecated and here replaced by MNXM1104589
!!! Alternative mappings exist !!!
| Properties | Image |
MNX_ID | MNXM1104589 |
 |
reference | chebi:181312 |
formula | C6H14O6 |
global charge | 0 |
mol weight | 182.172 |
InChIKey | FBPFZTCFMRRESA-NQAPHZHOSA-N |
InChI | InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4?,5+,6+/m1/s1 |
SMILES | OCC(O)[C@H](O)[C@@H](O)[C@H](O)CO |
MNX internals
InChI (mnx) | InChI=1/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4?,5+,6+/m1/s1 |
 |
SMILES (mnx) | [CH2:1]([C@H:3]([C@@H:5]([C@H:6]([CH:4]([CH2:2][OH:8])[OH:10])[OH:12])[OH:11])[OH:9])[OH:7] |
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Parent-child relations graph |
Occurences in reactions | #reac |
in my sandbox |
0 |
in MNXref (generic) | 0 |
in models (compartimentalized) |
0 |
|
Similar chemical compounds in external resources
Identifier | Description |
CHEBI:181312 chebi:181312 FBPFZTCFMRRESA-NQAPHZHOSA-N
| (3S,4S,5R)-Hexane-1,2,3,4,5,6-hexol (3S,4S,5R)-hexane-1,2,3,4,5,6-hexol
|
hmdb:HMDB0250766 FBPFZTCFMRRESA-UHFFFAOYSA-N
| D-Iditol hexane-1,2,3,4,5,6-hexol sorbitol
|
metacyc.compound:Hexitols metacycM:Hexitols FBPFZTCFMRRESA-UHFFFAOYSA-N
| a hexitol
|
CHEBI:125392 chebi:125392 FBPFZTCFMRRESA-UHFFFAOYSA-N
| hexane-1,2,3,4,5,6-hexol
|