Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C65H92N14O18S2 |
Molecular Weight | 1421.639 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@@H](O)[C@@H](CO)NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)CN3CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC3)C(=O)N[C@@H](CC4=CC=C(O)C=C4)C(=O)N[C@H](CC5=CNC6=C5C=CC=C6)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1
InChI
InChIKey=RZHKDBRREKOZEW-AAXZNHDCSA-N
InChI=1S/C65H92N14O18S2/c1-39(81)51(36-80)72-64(96)53-38-99-98-37-52(73-60(92)48(28-41-10-4-3-5-11-41)68-54(84)32-76-20-22-77(33-55(85)86)24-26-79(35-57(89)90)27-25-78(23-21-76)34-56(87)88)63(95)70-49(29-42-15-17-44(83)18-16-42)61(93)71-50(30-43-31-67-46-13-7-6-12-45(43)46)62(94)69-47(14-8-9-19-66)59(91)75-58(40(2)82)65(97)74-53/h3-7,10-13,15-18,31,39-40,47-53,58,67,80-83H,8-9,14,19-30,32-38,66H2,1-2H3,(H,68,84)(H,69,94)(H,70,95)(H,71,93)(H,72,96)(H,73,92)(H,74,97)(H,75,91)(H,85,86)(H,87,88)(H,89,90)/t39-,40-,47+,48-,49+,50-,51-,52+,53+,58+/m1/s1
Molecular Formula | C65H92N14O18S2 |
Molecular Weight | 1421.639 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 10 / 10 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:26:38 UTC 2023
by
admin
on
Fri Dec 15 16:26:38 UTC 2023
|
Record UNII |
U194AS08HZ
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Official Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Code | English | ||
|
Code | English | ||
|
Common Name | English | ||
|
Common Name | English |
Classification Tree | Code System | Code | ||
---|---|---|---|---|
|
NCI_THESAURUS |
C62799
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
||
|
FDA ORPHAN DRUG |
160902
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
204318-14-9
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
CHEMBL408350
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
SUB179386
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
100000164814
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
8032
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
158782
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
m4831
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | Merck Index | ||
|
C106246
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
U194AS08HZ
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
DTXSID701021591
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
OO-07
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
C2616
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY | |||
|
EDOTREOTIDE
Created by
admin on Fri Dec 15 16:26:38 UTC 2023 , Edited by admin on Fri Dec 15 16:26:38 UTC 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
SALT/SOLVATE -> PARENT |
|
||
|
SALT/SOLVATE -> PARENT |
|
||
|
LABELED -> NON-LABELED |
|
||
|
PARENT -> DERIVATIVE |
|
||
|
LABELED -> NON-LABELED |
|
||
|
TARGET->LIGAND |
|
||
|
LABELED -> NON-LABELED |
|
||
|
SALT/SOLVATE -> PARENT |
|
||
|
LABELED -> NON-LABELED |
|
||
|
SALT/SOLVATE -> PARENT |
|
Related Record | Type | Details | ||
---|---|---|---|---|
|
ACTIVE MOIETY |
|