Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 2,3-Butanediol | HCID 262 | — |
| Reactant | Hexitol | HCID 453 | — |
| Reactant | 1,4-Butanediol | HCID 8064 | — |
| Reactant | 1,3-Propanediol | HCID 10442 | — |
| Reactant | GlyTouCan:G09597LJ | HCID 24749 | — |
| Reactant | 1,1,1-Propanetriol | HCID 3017849 | — |
| Reactant | Lead | HCID 5352425 | — |
| Product | Hexitol | HCID 453 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (9/10) |
|---|
| ORD ID | ord-e549d445dc694169b6aa7a936400f9d1 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (9/10) |
|---|
