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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H15B2N3O12
Molecular Weight 414.882
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BORON ASPARTATE

SMILES

N[C@@H](CC(=O)OB1OC(=O)C[C@H](N)C(=O)O1)C(=O)OB2OC(=O)C[C@H](N)C(=O)O2

InChI

InChIKey=SHJCLISVYQCXKB-ZLUOBGJFSA-N
InChI=1S/C12H15B2N3O12/c15-4-1-7(18)24-13(27-10(4)21)25-8(19)2-5(16)11(22)28-14-26-9(20)3-6(17)12(23)29-14/h4-6H,1-3,15-17H2/t4-,5-,6-/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H15B2N3O12
Molecular Weight 414.882
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:42:31 GMT 2023
Edited
by admin
on Sat Dec 16 18:42:31 GMT 2023
Record UNII
TBJ36ZDH9Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BORON ASPARTATE
Common Name English
BIS((S)-5-AMINO-4,7-DIOXO-1,3,2-DIOXABOREPAN-2-YL) L-ASPARTATE
Systematic Name English
Boron aspartate [WHO-DD]
Common Name English
Code System Code Type Description
CAS
2493276-65-4
Created by admin on Sat Dec 16 18:42:31 GMT 2023 , Edited by admin on Sat Dec 16 18:42:31 GMT 2023
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SMS_ID
300000039327
Created by admin on Sat Dec 16 18:42:31 GMT 2023 , Edited by admin on Sat Dec 16 18:42:31 GMT 2023
PRIMARY
PUBCHEM
163203580
Created by admin on Sat Dec 16 18:42:31 GMT 2023 , Edited by admin on Sat Dec 16 18:42:31 GMT 2023
PRIMARY
FDA UNII
TBJ36ZDH9Y
Created by admin on Sat Dec 16 18:42:31 GMT 2023 , Edited by admin on Sat Dec 16 18:42:31 GMT 2023
PRIMARY