Details
Stereochemistry | EPIMERIC |
Molecular Formula | C27H37N3O7S.C3H8O2 |
Molecular Weight | 623.758 |
Optical Activity | ( - ) |
Defined Stereocenters | 5 / 6 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(O)CO.[H][C@]12OCC[C@@]1([H])[C@H](CO2)OC(=O)N[C@@H](CC3=CC=CC=C3)[C@H](O)CN(CC(C)C)S(=O)(=O)C4=CC=C(N)C=C4
InChI
InChIKey=LMVMDGVDHYKETG-VBTXLZOXSA-N
InChI=1S/C27H37N3O7S.C3H8O2/c1-18(2)15-30(38(33,34)21-10-8-20(28)9-11-21)16-24(31)23(14-19-6-4-3-5-7-19)29-27(32)37-25-17-36-26-22(25)12-13-35-26;1-3(5)2-4/h3-11,18,22-26,31H,12-17,28H2,1-2H3,(H,29,32);3-5H,2H2,1H3/t22-,23-,24+,25-,26+;/m0./s1
Molecular Formula | C27H37N3O7S |
Molecular Weight | 547.664 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C3H8O2 |
Molecular Weight | 76.0944 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:26:51 UTC 2023
by
admin
on
Sat Dec 16 10:26:51 UTC 2023
|
Record UNII |
6M6D7F3VC7
|
Record Status |
Validated (UNII)
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Record Version |
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-
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71666654
Created by
admin on Sat Dec 16 10:26:51 UTC 2023 , Edited by admin on Sat Dec 16 10:26:51 UTC 2023
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6M6D7F3VC7
Created by
admin on Sat Dec 16 10:26:51 UTC 2023 , Edited by admin on Sat Dec 16 10:26:51 UTC 2023
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100000170431
Created by
admin on Sat Dec 16 10:26:51 UTC 2023 , Edited by admin on Sat Dec 16 10:26:51 UTC 2023
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1447721-06-3
Created by
admin on Sat Dec 16 10:26:51 UTC 2023 , Edited by admin on Sat Dec 16 10:26:51 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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