UCSF

ZINC25669369

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2009 13 No

Popular Name: 3-Dehydro-L-gulonate 3-Dehydro-L-gulonate

Find On: PubMed — Wikipedia — Google

CAS Numbers: 342385-52-8 , 3470-37-9 , 526-98-7

Other Names:

(2S,4R,5S)-2,4,5,6-tetrahydroxy-3-oxohexanoate; 3-dehydro-L-gulonate; 3-dehydro-L-gulonate anion

2-dehydro-D-gluconate

2-dehydro-D-gluconate; 2-Dehydro-L-idonate; 2-keto-D-gluconate; 2-keto-L-gulonate; 2-Ketoidonate; 2-Oxogluconic acid; L-Ketoidonate; L-Ketoidonic acid; L-sorbosonate; L-sorbosonic acid; provitamin C

2-Dehydro-D-gluconate;2-Dehydro-L-idonate;2-Keto-D-gluconate;2-Keto-L-gulonate;2-Ketoidonate;2-Oxogluconic acid;L-Ketoidonate;L-Ketoidonic acid;L-Sorbosonate;L-Sorbosonic acid;Provitamin C

2-dehydro-L-gulonate; 2-dehydro-L-idonate; 2-keto-L-gulonate; 2-keto-L-idonate; 2-oxo-L-gulonate; 2oxo-L-idonate; CPD-13059; L-sorbosonate

2-dehydro-L-idonate

2-Dehydro-L-idonate; 2-Dehydro-L-idonic acid; 2-Keto-L-gulonate; 2-Keto-L-gulonic acid; 526-98-7; C15673; L-Ketoidonate; L-Ketoidonic acid; L-Sorbosonate; L-Sorbosonic acid; L-xylo-Hex-2-ulosonic acid

2-Dehydro-L-idonate; 2-Keto-L-gulonate; 2-Oxo-L-gulonate; 2-dehydro-L-idonate; L-Sorbosonate; L-xylo-hex-2-ulosonate

2-dehydro-L-idonic acid

2-Keto-L-gluconate

2-Keto-l-gulonic acid hydrate

2-Keto-L-gulonic acid; 2-Oxo-l-gulonic acid; 3-keto-L-Gulonic acid; L-Xylohexulosonic acid; L-xylo-2-Hexulosonic acid; L-xylo-hex-2-ulosonic acid

2-Keto-L-gulonsure

2-Oxogluconic acid; D-arabino-2-Hexulosonic acid; D-arabino-Hexulosonic acid; EINECS 211-574-9; LS-195277

3-dehydro-L-gulonate; 3-keto-L-gulonate

3-Dehydro-L-gulonate; C00618

3-dehydro-L-gulonic acid

3-dehydro-L-gulonic acid; L-xylo-hex-3-ulosonic acid

3-Dehydro-L-gulonic acid;L-Xylo-hex-3-ulosonic acid

CHEBI:11777; CHEBI:19992; CHEBI:1482

D-arabino-2-Hexulosonicacid, calcium salt (2:1)

MFCD10565650

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -3.62 -4.54 -45.22 4 7 -1 138 193.131 5 ↓

Vendor Notes

Note Type Comments Provided By
UniProt Database Links CRYL1_BOVIN; CRYL1_HUMAN; CRYL1_MOUSE; CRYL1_PIG; CRYL1_PONAB; CRYL1_RABIT; CRYL1_RAT; LYXK_ECOLI; SGBH_ECOLI; SGBH_HAEIN; ULAD_ECO24; ULAD_ECO27; ULAD_ECO45; ULAD_ECO55; ULAD_ECO57; ULAD_ECO5E; ULAD_ECO7I; ULAD_ECO81; ULAD_ECO8A; ULAD_ECOBW; ULAD_ECODH ChEBI
UniProt Database Links GHRB_ECOLI; TKRA_DICDI ChEBI
UniProt Database Links SNDH_GLULI ChEBI

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )