Compound Selection

Formula: C14H26CaO16

MW: 490.43

CAS: 10030-53-2

MDL NUMBER: MFCD00014340

Smiles: C([C@@H]([C@@H]([C@H]([C@@H]([C@H](O)CO)O)O)O)O)(O[Ca]OC([C@@H]([C@@H]([C@H]([C@@H]([C@H](O)CO)O)O)O)O)=O)=O

THERAPEUTIC CATEGORY: a calcium replenisher

ACCEPTORS: 16

DONORS: 12

ROTATION BONDS: 18

N+O: 16

Chiral Centers: 10

LogP:

LogS:

LIPINSKI:

Synonyms: ALPHA-D-GLUCOHEPTONIC ACID CALCIUM SALT DIHYDRATE;ALPHA-D-GLUCOHEPTONIC ACID CALCIUM SALT HYDRATE;D-GLYCERO-D-GLUCOHEPTONIC ACID CALCIUM SALT DIHYDRATE;CALCIUM ALPHA-D-HEPTAGLUCONATE DIHYDRATE;CALCIUM ALPHA-D-HEPTAGLUCONATE HYDRATE;calcium a-d-heptagluconate dihydrate;a-d-glucoheptonic acid calcium salt;a-D-Glucoheptonic acid calcium salt, D-Glycero-D-glucoheptonic acid calcium salt

CAS:10030-53-2

MF:C14H30CaO18

MW:526.46

EINECS:241-203-6

Product Categories: ALPHA-D-GLUCOHEPTONIC ACID CALCIUM SALT DIHYDRATE Safety Statements 22-24/25 WGK Germany 3 RTECS MA7980000 ALPHA-D-GLUCOHEPTONIC ACID CALCIUM SALT DIHYDRATE

Usage And Synthesis: ALPHA-D-GLUCOHEPTONIC ACID CALCIUM SALT DIHYDRATE

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MyriaScreen II – diversity screening library from Sigma-Aldrich and TimTec
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