Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H30N2O3S |
Molecular Weight | 402.55 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(CNCC[C@]2(CCO[C@]3(CC[C@H](O)C3)C2)C4=NC=CC=C4)SC=C1
InChI
InChIKey=SZOQKBVDLSSORA-WTOYTKOKSA-N
InChI=1S/C22H30N2O3S/c1-26-18-6-13-28-19(18)15-23-11-8-21(20-4-2-3-10-24-20)9-12-27-22(16-21)7-5-17(25)14-22/h2-4,6,10,13,17,23,25H,5,7-9,11-12,14-16H2,1H3/t17-,21+,22-/m0/s1
Molecular Formula | C22H30N2O3S |
Molecular Weight | 402.55 |
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
Sat Dec 16 17:28:25 GMT 2023
by
admin
on
Sat Dec 16 17:28:25 GMT 2023
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Record UNII |
6UDH2YDN71
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Record Status |
Validated (UNII)
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Record Version |
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-
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154925832
Created by
admin on Sat Dec 16 17:28:26 GMT 2023 , Edited by admin on Sat Dec 16 17:28:26 GMT 2023
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PRIMARY | |||
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6UDH2YDN71
Created by
admin on Sat Dec 16 17:28:25 GMT 2023 , Edited by admin on Sat Dec 16 17:28:25 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> METABOLITE |
URINE
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