Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C29H32N2O6S |
| Molecular Weight | 536.639 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC([C@@H]2SC3=C(C=CC=C3)N(C)C2=O)=C(OCCCN(C)CCOC4=CC5=C(OCO5)C=C4)C=C1
InChI
InChIKey=RKXVEXUAWGRFNP-NDEPHWFRSA-N
InChI=1S/C29H32N2O6S/c1-30(14-16-34-21-10-12-25-26(18-21)37-19-36-25)13-6-15-35-24-11-9-20(33-3)17-22(24)28-29(32)31(2)23-7-4-5-8-27(23)38-28/h4-5,7-12,17-18,28H,6,13-16,19H2,1-3H3/t28-/m0/s1
| Molecular Formula | C29H32N2O6S |
| Molecular Weight | 536.639 |
| 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
Edited
Fri Dec 15 16:38:13 UTC 2023
by
admin
on
Fri Dec 15 16:38:13 UTC 2023
|
| Record UNII |
9VDH1G55NC
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Official Name | English | ||
|
Common Name | English | ||
|
Systematic Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
|
NCI_THESAURUS |
C29707
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
100000082304
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
PRIMARY | |||
|
DTXSID401036181
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
PRIMARY | |||
|
SUB08492MIG
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
PRIMARY | |||
|
CHEMBL2105033
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
PRIMARY | |||
|
9852564
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
PRIMARY | |||
|
7303
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
PRIMARY | |||
|
C87284
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
PRIMARY | |||
|
116476-16-5
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
PRIMARY | |||
|
C064356
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
PRIMARY | |||
|
9VDH1G55NC
Created by
admin on Fri Dec 15 16:38:13 UTC 2023 , Edited by admin on Fri Dec 15 16:38:13 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
ENANTIOMER -> ENANTIOMER |
|
||
|
|
SALT/SOLVATE -> PARENT |
|
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
ACTIVE MOIETY |
|
