Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C60H86N16O13 |
Molecular Weight | 1239.4242 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 9 / 9 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](COC(C)(C)C)NC(=O)[C@@H](CC2=CC=C(O)C=C2)NC(=O)[C@H](CO)NC(=O)[C@H](CC3=CNC4=CC=CC=C34)NC(=O)[C@H](CC5=CN=CN5)NC(=O)[C@@H]6CCC(=O)N6
InChI
InChIKey=CUWODFFVMXJOKD-WQVASJQXSA-N
InChI=1S/C60H86N16O13/c1-7-64-57(87)48-15-11-23-76(48)58(88)41(14-10-22-65-59(61)62)69-51(81)42(24-33(2)3)70-56(86)47(31-89-60(4,5)6)75-52(82)43(25-34-16-18-37(78)19-17-34)71-55(85)46(30-77)74-53(83)44(26-35-28-66-39-13-9-8-12-38(35)39)72-54(84)45(27-36-29-63-32-67-36)73-50(80)40-20-21-49(79)68-40/h8-9,12-13,16-19,28-29,32-33,40-48,66,77-78H,7,10-11,14-15,20-27,30-31H2,1-6H3,(H,63,67)(H,64,87)(H,68,79)(H,69,81)(H,70,86)(H,71,85)(H,72,84)(H,73,80)(H,74,83)(H,75,82)(H4,61,62,65)/t40-,41-,42-,43+,44-,45-,46-,47+,48-/m0/s1
Molecular Formula | C60H86N16O13 |
Molecular Weight | 1239.4242 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 9 / 9 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:49:50 GMT 2023
by
admin
on
Sat Dec 16 19:49:50 GMT 2023
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Record UNII |
Q2HGT88MN7
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Record Status |
Validated (UNII)
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Record Version |
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-
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Q2HGT88MN7
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131847954
Created by
admin on Sat Dec 16 19:49:50 GMT 2023 , Edited by admin on Sat Dec 16 19:49:50 GMT 2023
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1426174-33-5
Created by
admin on Sat Dec 16 19:49:50 GMT 2023 , Edited by admin on Sat Dec 16 19:49:50 GMT 2023
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PARENT -> IMPURITY |
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