Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C53H88N16O16S3 |
| Molecular Weight | 1301.558 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 10 / 10 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CSCC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](CS)C(O)=O
InChI
InChIKey=SSKAMELTYQFUBJ-GFGZGKCBSA-N
InChI=1S/C53H88N16O16S3/c1-26(2)20-35(48(81)63-33(14-15-40(71)72)45(78)64-34(16-19-88-5)46(79)68-37(22-28-10-12-29(70)13-11-28)49(82)69-39(25-87)51(84)85)66-44(77)32(9-7-18-60-53(57)58)61-43(76)31(8-6-17-59-52(55)56)62-47(80)36(21-27(3)4)67-50(83)38(23-41(73)74)65-42(75)30(54)24-86/h10-13,26-27,30-39,70,86-87H,6-9,14-25,54H2,1-5H3,(H,61,76)(H,62,80)(H,63,81)(H,64,78)(H,65,75)(H,66,77)(H,67,83)(H,68,79)(H,69,82)(H,71,72)(H,73,74)(H,84,85)(H4,55,56,59)(H4,57,58,60)/t30-,31-,32-,33-,34-,35-,36-,37-,38-,39-/m0/s1
| Molecular Formula | C53H88N16O16S3 |
| Molecular Weight | 1301.558 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 10 / 10 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 18:55:36 GMT 2023
by
admin
on
Sat Dec 16 18:55:36 GMT 2023
|
| Record UNII |
alternative record
|
| Record Status |
alternative
|
| Record Version |
|
-
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