Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C35H46ClN5O9S |
Molecular Weight | 750.278 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CN=C(O[C@@H]2C[C@H](N(C2)[14C](=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)N[C@@]3(C[C@H]3C=C)C(=O)NS(=O)(=O)C4CC4)C5=C1C=CC(Cl)=C5
InChI
InChIKey=XRWSZZJLZRKHHD-VXHNCWRCSA-N
InChI=1S/C35H46ClN5O9S/c1-9-19-16-35(19,31(44)40-51(46,47)22-11-12-22)39-28(42)25-15-21(49-29-24-14-20(36)10-13-23(24)26(48-8)17-37-29)18-41(25)30(43)27(33(2,3)4)38-32(45)50-34(5,6)7/h9-10,13-14,17,19,21-22,25,27H,1,11-12,15-16,18H2,2-8H3,(H,38,45)(H,39,42)(H,40,44)/t19-,21-,25+,27-,35-/m1/s1/i30+2
Molecular Formula | C35H46ClN5O9S |
Molecular Weight | 750.278 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:29:15 GMT 2023
by
admin
on
Sat Dec 16 19:29:15 GMT 2023
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Record UNII |
NV9GDA4JP6
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Record Status |
Validated (UNII)
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Record Version |
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-
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Code System | Code | Type | Description | ||
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NV9GDA4JP6
Created by
admin on Sat Dec 16 19:29:16 GMT 2023 , Edited by admin on Sat Dec 16 19:29:16 GMT 2023
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2071659-39-5
Created by
admin on Sat Dec 16 19:29:16 GMT 2023 , Edited by admin on Sat Dec 16 19:29:16 GMT 2023
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166451436
Created by
admin on Sat Dec 16 19:29:16 GMT 2023 , Edited by admin on Sat Dec 16 19:29:16 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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NON-LABELED -> LABELED |
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