Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C45H54N4O8.2C4H6O6 |
Molecular Weight | 1079.1059 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 12 / 12 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]([C@@H](O)C(O)=O)C(O)=O.O[C@H]([C@@H](O)C(O)=O)C(O)=O.[H][C@@]12N3CC[C@@]14C5=CC(=C(OC)C=C5N(C)[C@@]4([H])[C@](O)([C@H](OC(C)=O)[C@]2(CC)C=CC3)C(=O)OC)[C@]6(C[C@H]7CN(CC(CC)=C7)CC8=C6NC9=C8C=CC=C9)C(=O)OC
InChI
InChIKey=CILBMBUYJCWATM-PYGJLNRPSA-N
InChI=1S/C45H54N4O8.2C4H6O6/c1-8-27-19-28-22-44(40(51)55-6,36-30(25-48(23-27)24-28)29-13-10-11-14-33(29)46-36)32-20-31-34(21-35(32)54-5)47(4)38-43(31)16-18-49-17-12-15-42(9-2,37(43)49)39(57-26(3)50)45(38,53)41(52)56-7;2*5-1(3(7)8)2(6)4(9)10/h10-15,19-21,28,37-39,46,53H,8-9,16-18,22-25H2,1-7H3;2*1-2,5-6H,(H,7,8)(H,9,10)/t28-,37-,38+,39+,42+,43+,44-,45-;2*1-,2-/m011/s1
Molecular Formula | C4H6O6 |
Molecular Weight | 150.0868 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C45H54N4O8 |
Molecular Weight | 778.9323 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 7 / 8 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:39:41 UTC 2023
by
admin
on
Fri Dec 15 15:39:41 UTC 2023
|
Record UNII |
253GQW851Q
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Official Name | English | ||
|
Common Name | English | ||
|
Code | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Code | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English |
Classification Tree | Code System | Code | ||
---|---|---|---|---|
|
NCI_THESAURUS |
C67422
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
||
|
NCI_THESAURUS |
C932
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
||
|
FDA ORPHAN DRUG |
540716
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
||
|
FDA ORPHAN DRUG |
588417
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
253GQW851Q
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
11607738
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
EE-34
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
DTXSID5047825
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
C135619
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
ALTERNATIVE | |||
|
1714506
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
C1395
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
SUB20777
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
CHEMBL553025
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
253GQW851Q
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
m11457
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | Merck Index | ||
|
EU/3/18/2133
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
114527
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | RxNorm | ||
|
100000088235
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
DBSALT000447
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
53750
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
32296
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY | |||
|
125317-39-7
Created by
admin on Fri Dec 15 15:39:41 UTC 2023 , Edited by admin on Fri Dec 15 15:39:41 UTC 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
|
||
|
PARENT -> SALT/SOLVATE |
|
Related Record | Type | Details | ||
---|---|---|---|---|
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
||
|
IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
|
Related Record | Type | Details | ||
---|---|---|---|---|
|
ACTIVE MOIETY |
|