Dehydro-L-(+)-ascorbic acid dimer
PubChem CID: 4613280
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Dehydro-L-(+)-ascorbic acid dimer, 72691-25-9, dehydroascorbic acid dimer, Bis-DHA, 6,10,12,16-tetrahydroxy-2,4,8,11,14,18-hexaoxapentacyclo[10.6.0.01,15.03,7.03,10]octadecane-9,13-dione, DEHYDRO-L-(+)-ASCORBIC ACID DIMER, Dehydroascorbic acid, dimer, Bis(dehydro-L-ascorbic acid), CHEBI:132138, MUYNUOXIHSNESP-UHFFFAOYSA-N, DTXSID601036482, HY-154920, CS-0857303, 3,5a,6a,9-tetrahydroxytetrahydro-2H,8aH-furo[2',3':4,5]furo[3,4-b]furo[3',2':2,3]furo[3,4-e][1,4]dioxine-5,7(5aH,6aH)-dione |
|---|---|
| Topological Polar Surface Area | 170.0 |
| Hydrogen Bond Donor Count | 4.0 |
| Heavy Atom Count | 24.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 612.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 6,10,12,16-tetrahydroxy-2,4,8,11,14,18-hexaoxapentacyclo[10.6.0.01,15.03,7.03,10]octadecane-9,13-dione |
| Nih Violation | False |
| Prediction Hob | 0.0 |
| Xlogp | -4.3 |
| Is Pains | False |
| Molecular Formula | C12H12O12 |
| Prediction Swissadme | 0.0 |
| Inchi Key | MUYNUOXIHSNESP-UHFFFAOYSA-N |
| Fcsp3 | 0.8333333333333334 |
| Rotatable Bond Count | 0.0 |
| Compound Name | Dehydro-L-(+)-ascorbic acid dimer |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 348.033 |
| Formal Charge | 0.0 |
| Brenk Violation | False |
| Monoisotopic Mass | 348.033 |
| Hydrogen Bond Acceptor Count | 12.0 |
| Molecular Weight | 348.22 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 8.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | 0.6785608000000005 |
| Inchi | InChI=1S/C12H12O12/c13-3-1-19-11-5(3)21-7(15)9(11,17)23-10(18)8(16)22-6-4(14)2-20-12(6,10)24-11/h3-6,13-14,17-18H,1-2H2 |
| Smiles | C1C(C2C3(O1)C(C(=O)O2)(OC4(C(=O)OC5C4(O3)OCC5O)O)O)O |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Arabidopsis Thaliana (Plant) Rel Props:Source_db:cmaup_ingredients