Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C21H28O7S |
| Molecular Weight | 424.508 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(OC)C(OC)=C2CCC3=C(CC[C@]4(C)[C@H](CC[C@@H]34)OS(O)(=O)=O)C2=C1
InChI
InChIKey=JMZGMDPXMHHCGP-MDKPJZGXSA-N
InChI=1S/C21H28O7S/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/h11,16,18H,5-10H2,1-4H3,(H,22,23,24)/t16-,18-,21-/m0/s1
| Molecular Formula | C21H28O7S |
| Molecular Weight | 424.508 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 21:39:13 GMT 2025
by
admin
on
Mon Mar 31 21:39:13 GMT 2025
|
| Record UNII |
NR80M0W0GK
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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47620-70-2
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NR80M0W0GK
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admin on Mon Mar 31 21:39:13 GMT 2025 , Edited by admin on Mon Mar 31 21:39:13 GMT 2025
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71587056
Created by
admin on Mon Mar 31 21:39:13 GMT 2025 , Edited by admin on Mon Mar 31 21:39:13 GMT 2025
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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SALT/SOLVATE -> PARENT |
