Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C27H32BrN5O7 |
Molecular Weight | 618.476 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=NC=C(CC2=C(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)N=C(NCCCCC4=C(C)C=C(Br)C=N4)N=C2)C=C1
InChI
InChIKey=SAXYSUKTXHPMDM-YVIDDRJESA-N
InChI=1S/C27H32BrN5O7/c1-14-9-18(28)13-31-19(14)5-3-4-8-29-27-32-12-17(10-16-7-6-15(2)30-11-16)24(33-27)40-26-22(36)20(34)21(35)23(39-26)25(37)38/h6-7,9,11-13,20-23,26,34-36H,3-5,8,10H2,1-2H3,(H,37,38)(H,29,32,33)/t20-,21-,22+,23-,26-/m0/s1
Molecular Formula | C27H32BrN5O7 |
Molecular Weight | 618.476 |
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 15:20:33 GMT 2023
by
admin
on
Sat Dec 16 15:20:33 GMT 2023
|
Record UNII |
PHZ5WG35WQ
|
Record Status |
Validated (UNII)
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Record Version |
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-
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156028089
Created by
admin on Sat Dec 16 15:20:33 GMT 2023 , Edited by admin on Sat Dec 16 15:20:33 GMT 2023
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127824-28-6
Created by
admin on Sat Dec 16 15:20:33 GMT 2023 , Edited by admin on Sat Dec 16 15:20:33 GMT 2023
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PHZ5WG35WQ
Created by
admin on Sat Dec 16 15:20:33 GMT 2023 , Edited by admin on Sat Dec 16 15:20:33 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> METABOLITE |