Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C62H78N8O20S2 |
Molecular Weight | 1319.454 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(COC(=O)CCC(=O)OCC1=CN=CC=C1)[C@@H](OC(=O)CCC(=O)OCC2=CN=CC=C2)C(=O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)[C@H](OC(=O)CCC(=O)OCC3=CN=CC=C3)C(C)(C)COC(=O)CCC(=O)OCC4=CN=CC=C4
InChI
InChIKey=PCGCUXHCEFYPOT-YQOHNZFASA-N
InChI=1S/C62H78N8O20S2/c1-61(2,41-87-53(77)15-13-49(73)83-37-43-9-5-23-63-33-43)57(89-55(79)19-17-51(75)85-39-45-11-7-25-65-35-45)59(81)69-27-21-47(71)67-29-31-91-92-32-30-68-48(72)22-28-70-60(82)58(90-56(80)20-18-52(76)86-40-46-12-8-26-66-36-46)62(3,4)42-88-54(78)16-14-50(74)84-38-44-10-6-24-64-34-44/h5-12,23-26,33-36,57-58H,13-22,27-32,37-42H2,1-4H3,(H,67,71)(H,68,72)(H,69,81)(H,70,82)/t57-,58-/m0/s1
Molecular Formula | C62H78N8O20S2 |
Molecular Weight | 1319.454 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 18:49:04 GMT 2023
by
admin
on
Fri Dec 15 18:49:04 GMT 2023
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Record UNII |
9I7K4KJ1E4
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Record Status |
Validated (UNII)
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Record Version |
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-
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Code | English |
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C174579
Created by
admin on Fri Dec 15 18:49:04 GMT 2023 , Edited by admin on Fri Dec 15 18:49:04 GMT 2023
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76956918
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admin on Fri Dec 15 18:49:04 GMT 2023 , Edited by admin on Fri Dec 15 18:49:04 GMT 2023
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CHEMBL2103893
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admin on Fri Dec 15 18:49:04 GMT 2023 , Edited by admin on Fri Dec 15 18:49:04 GMT 2023
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SUB09607MIG
Created by
admin on Fri Dec 15 18:49:04 GMT 2023 , Edited by admin on Fri Dec 15 18:49:04 GMT 2023
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6028
Created by
admin on Fri Dec 15 18:49:04 GMT 2023 , Edited by admin on Fri Dec 15 18:49:04 GMT 2023
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100000082788
Created by
admin on Fri Dec 15 18:49:04 GMT 2023 , Edited by admin on Fri Dec 15 18:49:04 GMT 2023
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9I7K4KJ1E4
Created by
admin on Fri Dec 15 18:49:04 GMT 2023 , Edited by admin on Fri Dec 15 18:49:04 GMT 2023
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96922-80-4
Created by
admin on Fri Dec 15 18:49:04 GMT 2023 , Edited by admin on Fri Dec 15 18:49:04 GMT 2023
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C048080
Created by
admin on Fri Dec 15 18:49:04 GMT 2023 , Edited by admin on Fri Dec 15 18:49:04 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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ACTIVE MOIETY |