Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C46H54O16 |
| Molecular Weight | 862.9114 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 10 / 10 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC[C@H]1O[C@H](OC2=CC=C(CCCCCCC3=CC(C4=CC(CC(O)=O)=CC=C4)=C(O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)C=C3)C=C2C6=CC(CC(O)=O)=CC=C6)[C@@H](O)[C@@H](O)[C@@H]1O
InChI
InChIKey=RYWCQJDEHXJHRI-XJMXIVSISA-N
InChI=1S/C46H54O16/c47-23-35-39(53)41(55)43(57)45(61-35)59-33-15-13-25(19-31(33)29-11-5-9-27(17-29)21-37(49)50)7-3-1-2-4-8-26-14-16-34(60-46-44(58)42(56)40(54)36(24-48)62-46)32(20-26)30-12-6-10-28(18-30)22-38(51)52/h5-6,9-20,35-36,39-48,53-58H,1-4,7-8,21-24H2,(H,49,50)(H,51,52)/t35-,36-,39-,40-,41+,42+,43+,44+,45+,46+/m1/s1
| Molecular Formula | C46H54O16 |
| Molecular Weight | 862.9114 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 10 / 10 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 17:45:16 UTC 2023
by
admin
on
Sat Dec 16 17:45:16 UTC 2023
|
| Record UNII |
97B5KCW80W
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Official Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
|
NCI_THESAURUS |
C29712
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
||
|
NCI_THESAURUS |
C257
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
8074
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY | |||
|
187269-40-5
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY | |||
|
C72942
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY | |||
|
9811353
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY | |||
|
C496819
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY | |||
|
DB06197
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY | |||
|
m2496
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY | Merck Index | ||
|
CHEMBL1215923
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY | |||
|
100000177260
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY | |||
|
DTXSID8048783
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY | |||
|
97B5KCW80W
Created by
admin on Sat Dec 16 17:45:17 UTC 2023 , Edited by admin on Sat Dec 16 17:45:17 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
TARGET -> INHIBITOR |
|
||
|
TARGET -> INHIBITOR |
|
||
|
|
SALT/SOLVATE -> PARENT |
|
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
ACTIVE MOIETY |
|
