Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C67H103N17O16S |
Molecular Weight | 1434.704 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 15 / 15 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC[C@H](C)[C@H](N)C1=N[C@@H](CS1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H]2CCCCNC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CC(O)=O)NC(=O)[C@H](CC3=CN=CN3)NC(=O)[C@@H](CC4=CC=CC=C4)NC(=O)[C@@H](NC(=O)[C@@H](CCCN)NC2=O)[C@@H](C)CC=C
InChI
InChIKey=NXZOGWYPAUYHSR-NXIFAQLTSA-N
InChI=1S/C67H103N17O16S/c1-9-18-38(8)55-66(100)81-45(28-39-19-13-12-14-20-39)61(95)78-46(29-40-32-71-34-73-40)62(96)80-48(31-52(88)89)63(97)79-47(30-50(69)85)56(90)72-26-16-15-21-41(57(91)74-42(22-17-25-68)58(92)84-55)76-65(99)54(37(7)11-3)83-59(93)43(23-24-51(86)87)75-60(94)44(27-35(4)5)77-64(98)49-33-101-67(82-49)53(70)36(6)10-2/h9,12-14,19-20,32,34-38,41-49,53-55H,1,10-11,15-18,21-31,33,68,70H2,2-8H3,(H2,69,85)(H,71,73)(H,72,90)(H,74,91)(H,75,94)(H,76,99)(H,77,98)(H,78,95)(H,79,97)(H,80,96)(H,81,100)(H,83,93)(H,84,92)(H,86,87)(H,88,89)/t36-,37-,38-,41-,42+,43+,44-,45+,46-,47-,48+,49-,53-,54-,55-/m0/s1
Molecular Formula | C67H103N17O16S |
Molecular Weight | 1434.704 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 15 / 15 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 13:35:10 GMT 2025
by
admin
on
Wed Apr 02 13:35:10 GMT 2025
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Record UNII |
TVA7US8E9M
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Record Status |
Validated (UNII)
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Record Version |
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-
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Preferred Name | English | ||
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Systematic Name | English |
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171390014
Created by
admin on Wed Apr 02 13:35:10 GMT 2025 , Edited by admin on Wed Apr 02 13:35:10 GMT 2025
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TVA7US8E9M
Created by
admin on Wed Apr 02 13:35:10 GMT 2025 , Edited by admin on Wed Apr 02 13:35:10 GMT 2025
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1301601-40-0
Created by
admin on Wed Apr 02 13:35:10 GMT 2025 , Edited by admin on Wed Apr 02 13:35:10 GMT 2025
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> IMPURITY |
sum of impurities O, P and Q: maximum 2.5 per cent
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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