Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C25H34N2O11S |
| Molecular Weight | 570.609 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CCOC1=C(OCCN[C@H](C)CC2=CC(=C(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)C=C2)S(N)(=O)=O)C=CC=C1
InChI
InChIKey=CTLBCLDMUREQDB-PROXNBRHSA-N
InChI=1S/C25H34N2O11S/c1-3-35-16-6-4-5-7-17(16)36-11-10-27-14(2)12-15-8-9-18(19(13-15)39(26,33)34)37-25-22(30)20(28)21(29)23(38-25)24(31)32/h4-9,13-14,20-23,25,27-30H,3,10-12H2,1-2H3,(H,31,32)(H2,26,33,34)/t14-,20+,21+,22-,23+,25-/m1/s1
| Molecular Formula | C25H34N2O11S |
| Molecular Weight | 570.609 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 17:19:47 UTC 2023
by
admin
on
Sat Dec 16 17:19:47 UTC 2023
|
| Record UNII |
636E91C8QD
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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636E91C8QD
Created by
admin on Sat Dec 16 17:19:47 UTC 2023 , Edited by admin on Sat Dec 16 17:19:47 UTC 2023
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154731617
Created by
admin on Sat Dec 16 17:19:47 UTC 2023 , Edited by admin on Sat Dec 16 17:19:47 UTC 2023
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176223-39-5
Created by
admin on Sat Dec 16 17:19:47 UTC 2023 , Edited by admin on Sat Dec 16 17:19:47 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
URINE
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PARENT -> METABOLITE |
PLASMA
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