Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C37H59N13O13.3ClH |
| Molecular Weight | 1003.326 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 13 / 13 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.Cl.[H][C@@]12NC(=O)N(C(N)=O)[C@@]1([H])[C@]([H])(O[C@@H]3CO[C@H](NC(=O)N[C@@H]4[C@@H](C)O[C@H](OC5=CC=C(\C=C\C(=O)NCCCNCCCCN)C=C5)[C@H](NC(N)=N)[C@H]4O)[C@H](NC(N)=O)[C@H]3O)OC[C@H]2O
InChI
InChIKey=OLSHONKVUJKBLF-QHWDFDIQSA-N
InChI=1S/C37H59N13O13.3ClH/c1-17-23(29(54)26(45-33(39)40)31(61-17)62-19-8-5-18(6-9-19)7-10-22(52)44-14-4-13-43-12-3-2-11-38)47-36(57)49-30-25(46-34(41)55)28(53)21(16-59-30)63-32-27-24(20(51)15-60-32)48-37(58)50(27)35(42)56;;;/h5-10,17,20-21,23-32,43,51,53-54H,2-4,11-16,38H2,1H3,(H2,42,56)(H,44,52)(H,48,58)(H4,39,40,45)(H3,41,46,55)(H2,47,49,57);3*1H/b10-7+;;;/t17-,20-,21-,23-,24+,25-,26-,27-,28+,29+,30+,31-,32+;;;/m1.../s1
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C37H59N13O13 |
| Molecular Weight | 893.9437 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 13 / 13 |
| E/Z Centers | 1 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:28:32 GMT 2023
by
admin
on
Fri Dec 15 15:28:32 GMT 2023
|
| Record UNII |
P4ZNF2C8IY
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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68681-92-5
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72941590
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C90680
Created by
admin on Fri Dec 15 15:28:32 GMT 2023 , Edited by admin on Fri Dec 15 15:28:32 GMT 2023
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P4ZNF2C8IY
Created by
admin on Fri Dec 15 15:28:32 GMT 2023 , Edited by admin on Fri Dec 15 15:28:32 GMT 2023
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PRIMARY |