Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C38H52N6O2.CH4O3S |
| Molecular Weight | 720.964 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 6 / 6 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.[H][C@@]12C[C@@H](C)[C@H](C(=O)CN3CCN(CC3)C4=CC(=NC(=N4)N5CCCC5)N6CCCC6)[C@@]1(C)CC=C7[C@@]2([H])CCC8=CC(=O)C=C[C@]78C
InChI
InChIKey=HPZOOQSXPMEJBV-ODCFVKFUSA-N
InChI=1S/C38H52N6O2.CH4O3S/c1-26-22-31-29-9-8-27-23-28(45)10-12-37(27,2)30(29)11-13-38(31,3)35(26)32(46)25-41-18-20-43(21-19-41)34-24-33(42-14-4-5-15-42)39-36(40-34)44-16-6-7-17-44;1-5(2,3)4/h10-12,23-24,26,29,31,35H,4-9,13-22,25H2,1-3H3;1H3,(H,2,3,4)/t26-,29-,31+,35-,37+,38+;/m1./s1
| Molecular Formula | CH4O3S |
| Molecular Weight | 96.106 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C38H52N6O2 |
| Molecular Weight | 624.8585 |
| 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
Fri Dec 15 16:40:01 UTC 2023
by
admin
on
Fri Dec 15 16:40:01 UTC 2023
|
| Record UNII |
19B418DV39
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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19B418DV39
Created by
admin on Fri Dec 15 16:40:01 UTC 2023 , Edited by admin on Fri Dec 15 16:40:01 UTC 2023
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110101-67-2
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DTXSID40149144
Created by
admin on Fri Dec 15 16:40:01 UTC 2023 , Edited by admin on Fri Dec 15 16:40:01 UTC 2023
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104902
Created by
admin on Fri Dec 15 16:40:01 UTC 2023 , Edited by admin on Fri Dec 15 16:40:01 UTC 2023
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| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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SOLVATE->ANHYDROUS |
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ACTIVE MOIETY |
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