Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C75H115FN18O27S3 |
Molecular Weight | 1816.013 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 7 / 7 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
NC(=O)COCC(=O)NCCOCCOCCOCCNC(=O)[C@@H]1CSCC(=O)N[C@@H](CCCCNC(=O)COCC(=O)NCCOCCOCCOCCOCCOCCNC(=O)CO\N=C\C2=CC=C(F)C=C2)C(=O)N[C@H]3CSSC[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC3=O)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N1
InChI
InChIKey=VXFFXZSNVKXXIB-SCSBXPEDSA-N
InChI=1S/C75H115FN18O27S3/c76-52-13-11-51(12-14-52)39-87-121-45-65(100)83-19-23-113-27-31-117-34-36-118-35-33-116-30-26-112-22-18-82-64(99)44-120-43-62(97)80-15-5-4-9-54-70(106)93-58-47-123-124-48-59(94-72(108)56(38-67(102)103)89-61(96)40-86-68(104)53(90-73(58)109)10-6-16-85-75(78)79)74(110)91-55(37-50-7-2-1-3-8-50)71(107)92-57(46-122-49-66(101)88-54)69(105)84-20-24-114-28-32-115-29-25-111-21-17-81-63(98)42-119-41-60(77)95/h1-3,7-8,11-14,39,53-59H,4-6,9-10,15-38,40-49H2,(H2,77,95)(H,80,97)(H,81,98)(H,82,99)(H,83,100)(H,84,105)(H,86,104)(H,88,101)(H,89,96)(H,90,109)(H,91,110)(H,92,107)(H,93,106)(H,94,108)(H,102,103)(H4,78,79,85)/b87-39+/t53-,54-,55-,56-,57-,58-,59-/m0/s1
Molecular Formula | C75H115FN18O27S3 |
Molecular Weight | 1816.013 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 7 / 7 |
E/Z Centers | 6 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:49:22 GMT 2023
by
admin
on
Sat Dec 16 11:49:22 GMT 2023
|
Record UNII |
UQ6CV583Q3
|
Record Status |
Validated (UNII)
|
Record Version |
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-
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Code | English |
Code System | Code | Type | Description | ||
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59707743
Created by
admin on Sat Dec 16 11:49:22 GMT 2023 , Edited by admin on Sat Dec 16 11:49:22 GMT 2023
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PRIMARY | |||
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879894-00-5
Created by
admin on Sat Dec 16 11:49:22 GMT 2023 , Edited by admin on Sat Dec 16 11:49:22 GMT 2023
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PRIMARY | |||
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UQ6CV583Q3
Created by
admin on Sat Dec 16 11:49:22 GMT 2023 , Edited by admin on Sat Dec 16 11:49:22 GMT 2023
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PRIMARY | |||
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1033253-37-0
Created by
admin on Sat Dec 16 11:49:22 GMT 2023 , Edited by admin on Sat Dec 16 11:49:22 GMT 2023
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ALTERNATIVE |
Related Record | Type | Details | ||
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LABELED -> NON-LABELED |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |