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Substance Name: Calcium hopantenate [JAN]
RN: 76567-35-6
UNII: RQA63PEI5Q
InChIKey: NNHRASUFFPCRBJ-MIOUZRKOSA-J

Molecular Weight

  • 1027.1876
 
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Names and Synonyms

Name of Substance

  • Calcium hopantenate [JAN]

Synonyms

  • Calcium D-(+)-4-(2,4-dihydroxy-3,3-dimethylbutylamido)butyrate 1/2 hydrate
  • Calcium hopantenate
  • UNII-RQA63PEI5Q

Registry Numbers

CAS Registry Number

  • 76567-35-6

FDA UNII

  • RQA63PEI5Q

System Generated Number

  • 0076567356

Structure Descriptors

InChI

1S/4C10H19NO5.2Ca.H2O/c4*1-10(2,6-12)8(15)9(16)11-5-3-4-7(13)14;;;/h4*8,12,15H,3-6H2,1-2H3,(H,11,16)(H,13,14);;;1H2/q;;;;2*+2;/p-4/t4*8-;;;/m0000.../s1

InChIKey

NNHRASUFFPCRBJ-MIOUZRKOSA-J

Smiles

CC(C)(CO)[C@H](C(=O)NCCCC(=O)[O-])O.CC(C)(CO)[C@H](C(=O)NCCCC(=O)[O-])O.CC(C)(CO)[C@H](C(=O)NCCCC(=O)[O-])O.CC(C)(CO)[C@H](C(=O)NCCCC(=O)[O-])O.O.[Ca+2].[Ca+2]