Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C30H31N3O3.C4H4O4 |
| Molecular Weight | 597.6576 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C\C(O)=O.O[C@@H](COC1=C2C=CC=NC2=CC=C1)CN3CCN(CC3)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChIKey=QIAVTDQTRFYXSD-FMYYAHIMSA-N
InChI=1S/C30H31N3O3.C4H4O4/c34-25(22-36-28-15-7-14-27-26(28)13-8-16-31-27)21-32-17-19-33(20-18-32)30(35)29(23-9-3-1-4-10-23)24-11-5-2-6-12-24;5-3(6)1-2-4(7)8/h1-16,25,29,34H,17-22H2;1-2H,(H,5,6)(H,7,8)/b;2-1+/t25-;/m1./s1
| Molecular Formula | C30H31N3O3 |
| Molecular Weight | 481.5854 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C4H4O4 |
| Molecular Weight | 116.0722 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 21:15:06 GMT 2025
by
admin
on
Mon Mar 31 21:15:06 GMT 2025
|
| Record UNII |
5P06ZAB6YO
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Preferred Name | English | ||
|
Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
22854653
Created by
admin on Mon Mar 31 21:15:06 GMT 2025 , Edited by admin on Mon Mar 31 21:15:06 GMT 2025
|
PRIMARY | |||
|
153653-34-0
Created by
admin on Mon Mar 31 21:15:06 GMT 2025 , Edited by admin on Mon Mar 31 21:15:06 GMT 2025
|
PRIMARY | |||
|
5P06ZAB6YO
Created by
admin on Mon Mar 31 21:15:06 GMT 2025 , Edited by admin on Mon Mar 31 21:15:06 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
RACEMATE -> ENANTIOMER |
