Details
| Stereochemistry | MIXED |
| Molecular Formula | C21H28O7S.C7H17NO5 |
| Molecular Weight | 619.721 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[H][C@@]12CC[C@H](OS(O)(=O)=O)[C@@]1(C)CCC3=C2CCC4=C3C=C(OC)C(OC)=C4OC
InChI
InChIKey=YTQAIQKXHAVJKP-VMGOQGDESA-N
InChI=1S/C21H28O7S.C7H17NO5/c1-21-10-9-12-13(16(21)7-8-18(21)28-29(22,23)24)5-6-14-15(12)11-17(25-2)20(27-4)19(14)26-3;1-8-2-4(10)6(12)7(13)5(11)3-9/h11,16,18H,5-10H2,1-4H3,(H,22,23,24);4-13H,2-3H2,1H3/t16-,18-,21-;4-,5+,6+,7+/m00/s1
| Molecular Formula | C21H28O7S.C7H17NO5 |
| Molecular Weight | 619.721 |
| Charge | 0 |
| Count |
|
| Stereochemistry | MIXED |
| Additional Stereochemistry | No |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C21H28O7S.C7H17NO5 |
| Molecular Weight | 619.721 |
| Charge | 0 |
| Count |
|
| Stereochemistry | MIXED |
| Additional Stereochemistry | No |
| Defined Stereocenters | 7 / 7 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:49:51 GMT 2023
by
admin
on
Fri Dec 15 15:49:51 GMT 2023
|
| Record UNII |
F41JJH16FP
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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145925532
Created by
admin on Fri Dec 15 15:49:51 GMT 2023 , Edited by admin on Fri Dec 15 15:49:51 GMT 2023
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PRIMARY | |||
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F41JJH16FP
Created by
admin on Fri Dec 15 15:49:51 GMT 2023 , Edited by admin on Fri Dec 15 15:49:51 GMT 2023
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23257-46-7
Created by
admin on Fri Dec 15 15:49:51 GMT 2023 , Edited by admin on Fri Dec 15 15:49:51 GMT 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |