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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H36N2O5
Molecular Weight 420.5423
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BOC-DAP-NE

SMILES

[H][C@]1(CCCN1C(=O)OC(C)(C)C)[C@H](OC)[C@@H](C)C(=O)N[C@H](C)[C@@H](O)C2=CC=CC=C2

InChI

InChIKey=XJDVGABQIFOWFC-SCQOQHIRSA-N
InChI=1S/C23H36N2O5/c1-15(21(27)24-16(2)19(26)17-11-8-7-9-12-17)20(29-6)18-13-10-14-25(18)22(28)30-23(3,4)5/h7-9,11-12,15-16,18-20,26H,10,13-14H2,1-6H3,(H,24,27)/t15-,16-,18+,19-,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H36N2O5
Molecular Weight 420.5423
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:53:26 GMT 2023
Edited
by admin
on Sat Dec 16 18:53:26 GMT 2023
Record UNII
ASQ83R8UEA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BOC-DAP-NE
Common Name English
1,1-DIMETHYLETHYL (2S)-2-((1R,2R)-3-(((1R,2S)-2-HYDROXY-1-METHYL-2-PHENYLETHYL)AMINO)-1-METHOXY-2-METHYL-3-OXOPROPYL)-1-PYRROLIDINECARBOXYLATE
Common Name English
1-PYRROLIDINECARBOXYLIC ACID, 2-((1R,2R)-3-(((1R,2S)-2-HYDROXY-1-METHYL-2-PHENYLETHYL)AMINO)-1-METHOXY-2-METHYL-3-OXOPROPYL)-, 1,1-DIMETHYLETHYL ESTER, (2S)-
Systematic Name English
Code System Code Type Description
CAS
160800-65-7
Created by admin on Sat Dec 16 18:53:26 GMT 2023 , Edited by admin on Sat Dec 16 18:53:26 GMT 2023
PRIMARY
FDA UNII
ASQ83R8UEA
Created by admin on Sat Dec 16 18:53:26 GMT 2023 , Edited by admin on Sat Dec 16 18:53:26 GMT 2023
PRIMARY
PUBCHEM
20777964
Created by admin on Sat Dec 16 18:53:26 GMT 2023 , Edited by admin on Sat Dec 16 18:53:26 GMT 2023
PRIMARY