Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H29NO2.C10H8O3S |
Molecular Weight | 547.705 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(=O)(=O)C1=CC2=C(C=CC=C2)C=C1.CCC(=O)O[C@@](CC3=CC=CC=C3)([C@H](C)CN(C)C)C4=CC=CC=C4
InChI
InChIKey=VZPXFHVJUUSVLH-MYXGOWFTSA-N
InChI=1S/C22H29NO2.C10H8O3S/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19;11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10/h6-15,18H,5,16-17H2,1-4H3;1-7H,(H,11,12,13)/t18-,22+;/m1./s1
Molecular Formula | C22H29NO2 |
Molecular Weight | 339.4712 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C10H8O3S |
Molecular Weight | 208.234 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:13:06 UTC 2023
by
admin
on
Fri Dec 15 15:13:06 UTC 2023
|
Record UNII |
5O7IW35N3C
|
Record Status |
Validated (UNII)
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Record Version |
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-
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28332
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241-205-7
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23239-43-2
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17140-78-2
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5O7IW35N3C
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DTXSID80937986
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admin on Fri Dec 15 15:13:06 UTC 2023 , Edited by admin on Fri Dec 15 15:13:06 UTC 2023
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100000153447
Created by
admin on Fri Dec 15 15:13:06 UTC 2023 , Edited by admin on Fri Dec 15 15:13:06 UTC 2023
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Related Record | Type | Details | ||
---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE | |||
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SOLVATE->ANHYDROUS |