Details
Stereochemistry | ABSOLUTE |
Molecular Formula | 2C27H44N10O12.3H2O4S |
Molecular Weight | 1695.632 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 30 / 30 |
E/Z Centers | 2 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.OS(O)(=O)=O.OS(O)(=O)=O.[H][C@@]4(O[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](NC(N)=N)[C@@H](O)[C@@H]2NC(N)=N)O[C@@H](C)[C@]1(O)\C=N\NC(=O)C3=CC=NC=C3)O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4NC.[H][C@@]8(O[C@H]5[C@H](O[C@H]6[C@H](O)[C@@H](O)[C@H](NC(N)=N)[C@@H](O)[C@@H]6NC(N)=N)O[C@@H](C)[C@]5(O)\C=N\NC(=O)C7=CC=NC=C7)O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]8NC
InChI
InChIKey=OIOSFHRAQVHZRE-BZROWGSASA-N
InChI=1S/2C27H44N10O12.3H2O4S/c2*1-9-27(45,8-34-37-22(44)10-3-5-33-6-4-10)21(49-23-14(32-2)18(42)15(39)11(7-38)47-23)24(46-9)48-20-13(36-26(30)31)16(40)12(35-25(28)29)17(41)19(20)43;3*1-5(2,3)4/h2*3-6,8-9,11-21,23-24,32,38-43,45H,7H2,1-2H3,(H,37,44)(H4,28,29,35)(H4,30,31,36);3*(H2,1,2,3,4)/b2*34-8+;;;/t2*9-,11-,12+,13-,14-,15-,16+,17-,18-,19+,20+,21-,23-,24-,27+;;;/m00.../s1
Molecular Formula | H2O4S |
Molecular Weight | 98.078 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C27H44N10O12 |
Molecular Weight | 700.6981 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 15 / 15 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:36:59 GMT 2023
by
admin
on
Fri Dec 15 15:36:59 GMT 2023
|
Record UNII |
20R578ZX2B
|
Record Status |
Validated (UNII)
|
Record Version |
|
-
Download
Name | Type | Language | ||
---|---|---|---|---|
|
Official Name | English | ||
|
Systematic Name | English | ||
|
Common Name | English | ||
|
Brand Name | English | ||
|
Brand Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Common Name | English |
Classification Tree | Code System | Code | ||
---|---|---|---|---|
|
NCI_THESAURUS |
C280
Created by
admin on Fri Dec 15 15:36:59 GMT 2023 , Edited by admin on Fri Dec 15 15:36:59 GMT 2023
|
Code System | Code | Type | Description | ||
---|---|---|---|---|---|
|
227-128-1
Created by
admin on Fri Dec 15 15:36:59 GMT 2023 , Edited by admin on Fri Dec 15 15:36:59 GMT 2023
|
PRIMARY | |||
|
5667-71-0
Created by
admin on Fri Dec 15 15:36:59 GMT 2023 , Edited by admin on Fri Dec 15 15:36:59 GMT 2023
|
PRIMARY | |||
|
20R578ZX2B
Created by
admin on Fri Dec 15 15:36:59 GMT 2023 , Edited by admin on Fri Dec 15 15:36:59 GMT 2023
|
PRIMARY | |||
|
C009328
Created by
admin on Fri Dec 15 15:36:59 GMT 2023 , Edited by admin on Fri Dec 15 15:36:59 GMT 2023
|
PRIMARY | |||
|
CHEMBL2110590
Created by
admin on Fri Dec 15 15:36:59 GMT 2023 , Edited by admin on Fri Dec 15 15:36:59 GMT 2023
|
PRIMARY | |||
|
m937
Created by
admin on Fri Dec 15 15:36:59 GMT 2023 , Edited by admin on Fri Dec 15 15:36:59 GMT 2023
|
PRIMARY | Merck Index | ||
|
70695622
Created by
admin on Fri Dec 15 15:36:59 GMT 2023 , Edited by admin on Fri Dec 15 15:36:59 GMT 2023
|
PRIMARY | |||
|
7430-90-2
Created by
admin on Fri Dec 15 15:36:59 GMT 2023 , Edited by admin on Fri Dec 15 15:36:59 GMT 2023
|
NON-SPECIFIC STOICHIOMETRY | |||
|
C152438
Created by
admin on Fri Dec 15 15:36:59 GMT 2023 , Edited by admin on Fri Dec 15 15:36:59 GMT 2023
|
PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
---|---|---|---|---|
|
ACTIVE MOIETY |