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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H27NO4
Molecular Weight 309.4006
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of L-653328

SMILES

CC(=O)OCCC1=CC=C(OC[C@@H](O)CNC(C)(C)C)C=C1

InChI

InChIKey=YSAYHFMJDLPBGB-HNNXBMFYSA-N
InChI=1S/C17H27NO4/c1-13(19)21-10-9-14-5-7-16(8-6-14)22-12-15(20)11-18-17(2,3)4/h5-8,15,18,20H,9-12H2,1-4H3/t15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H27NO4
Molecular Weight 309.4006
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:46:52 UTC 2023
Edited
by admin
on Sat Dec 16 08:46:52 UTC 2023
Record UNII
5TET8Z0SGK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-653328
Code English
BENZENEETHANOL, 4-(3-((1,1-DIMETHYLETHYL)AMINO)-2-HYDROXYPROPOXY)-, ALPHA-ACETATE, (S)-
Systematic Name English
L-653,328
Code English
2-(4-((2S)-3-((1,1-DIMETHYLETHYL)AMINO)-2-HYDROXYPROPOXY)PHENYL)ETHYL ACETATE
Systematic Name English
BENZENEETHANOL, 4-((2S)-3-((1,1-DIMETHYLETHYL)AMINO)-2-HYDROXYPROPOXY)-, 1-ACETATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30921774
Created by admin on Sat Dec 16 08:46:52 UTC 2023 , Edited by admin on Sat Dec 16 08:46:52 UTC 2023
PRIMARY
FDA UNII
5TET8Z0SGK
Created by admin on Sat Dec 16 08:46:52 UTC 2023 , Edited by admin on Sat Dec 16 08:46:52 UTC 2023
PRIMARY
PUBCHEM
163971
Created by admin on Sat Dec 16 08:46:52 UTC 2023 , Edited by admin on Sat Dec 16 08:46:52 UTC 2023
PRIMARY
CAS
115609-61-5
Created by admin on Sat Dec 16 08:46:52 UTC 2023 , Edited by admin on Sat Dec 16 08:46:52 UTC 2023
PRIMARY
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