UCSF

ZINC01531007

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 15 Yes

Popular Name: Sodium (2R,3R,4S,5R,6R)-2,3,4,5,6,7-hexahydroxyheptanoate Sodium (2R,3R,4S,5R,6R)-2,3,4,5,…

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CAS Numbers: 10030-53-2 , 13007-85-7 , 17140-60-2 , 23351-51-1 , 29039-00-7 , 31138-65-5 , [68475-44-5]

Other Names:

(2R,3R,4S,5R,6R)-2,3,4,5,6,7-Hexahydroxyheptanoic acid

(2R,3R,4S,5R,6R)-2,3,4,5,6,7-hexahydroxyheptanoic acid; alpha-glucoheptonic acid

(2xi)-D-gluco-heptonate

(2xi)-D-glycero-D-gulo-heptonate; (2xi)-D-glycero-D-gulo-heptonate(1-); (2xi)-D-glycero-D-ido-heptonate; (2xi)-D-glycero-D-ido-heptonate(1-); (3R,4S,5R,6R)-2,3,4,5,6,7-hexahydroxyheptanoate

ium

13007-85-7; D04330; Gluceptate sodium (USAN)

29039-00-7; Calcium gluceptate (TN); Calcium gluceptate (USP); Calcium glucoheptonate (INN); D00934

calci-

Calcihept; Calcii glucoheptonas [Latin]; Calcium D-glycero-D-gulo-heptonate (1:2); Calcium alpha-glucoheptonate; Calcium gluceptate; Calcium glucoheptanoate; Calcium glucoheptonate; Calcium heptagluconate; Calcium-alpha-D-glucoheptonate; Calcium-bis(D-gly

calcii glucoheptonas; calcium glucoheptonate; glucoheptonate de calcium; glucoheptonato calcico

calcium (2xi)-D-gluco-heptonate; calcium bis[(2xi)-D-glycero-D-gulo-heptonate]; calcium bis[(2xi)-D-glycero-D-ido-heptonate]; calcium bis[(3R,4S,5R,6R)-2,3,4,5,6,7-hexahydroxyheptanoate]; calcium gluceptate; calcium glucoheptonate (1:2)

Calcium alpha-d-heptagluconate dihydrate

Calcium Gluceptate

Calcium Gluceptate (FDA

CALCIUM GLUCEPTATE,HEMIHEPTAHYDRATE

Calcium glucoheptonate

Calcium glucoheptonate;Trimethylene chlorobromide

Calcium Stanley

D-Gluco-heptonic acid, monosodium salt, (2.xi)-; D-gluco-Heptonic acid, monosodium salt, (2xi)-; EINECS 250-480-2; LS-3095; Monosodium D-glucoheptonate; Sodium glucoheptonate

Gluceptate Sodium (USAN)

glucoheptonic acid

Glucoheptonic acid,sodium salt

INN)

LS-187351

Magnesium a-glucoheptonate

MFCD00013425

MFCD00065923

MFCD00067183

MFCD00150972

N/A

SODIUM GLUCOHEPTONATE

Sodium Glucoheptonate Dihydrate

Technetium Tc 99M Gluceptate (USP); Technetium Tc-99M Gluceptate Kit (FDA)

Technetium Tc-99m Gluceptate Kit (FDA); Technetium Tc 99m Gluceptate (USP)

Trimethylene chlorobromide

USP); Calcium Glucoheptonate (DCF

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) -3.64 -12.04 -51.3 6 8 -1 161 225.173 6 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 3.98e+01 g/l DrugBank-approved
Purity 85% Fluorochem
Purity 85+% Fluorochem
PUBCHEM_PATENT_ID EP0192367A2; EP0204737A1; EP0204737B1; EP0263224A2; EP0263224B1; EP0304986A2; EP0304986B1; EP0304987A2; EP0304987B1; EP0346866A2; EP0435797A1; EP0435797B1; EP0627924A1; EP0627924B1; EP0633767A1; EP0633767B1; EP0648495A2; EP0648495A3; EP0648495B1; EP071011 IBM Patent Data
Target Others Selleck Chemicals

Activity (Go SEA)

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