Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C77H137N19O20S4 |
| Molecular Weight | 1777.287 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 17 / 17 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC[C@H](C)[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(=O)[C@H](C)N)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(N)=O)C(O)=O
InChI
InChIKey=KXSHTCZIAICPBE-ZSYOOXFBSA-N
InChI=1S/C77H137N19O20S4/c1-14-43(7)61(95-71(109)55(40-59(99)100)91-66(104)48(24-26-57(81)97)84-67(105)49(28-35-117-10)87-72(110)56-23-20-34-96(56)76(114)52(31-38-120-13)89-63(101)45(9)80)74(112)88-47(22-17-19-33-79)65(103)86-51(30-37-119-12)69(107)94-62(44(8)15-2)75(113)92-54(39-41(3)4)70(108)83-46(21-16-18-32-78)64(102)85-50(29-36-118-11)68(106)93-60(42(5)6)73(111)90-53(77(115)116)25-27-58(82)98/h41-56,60-62H,14-40,78-80H2,1-13H3,(H2,81,97)(H2,82,98)(H,83,108)(H,84,105)(H,85,102)(H,86,103)(H,87,110)(H,88,112)(H,89,101)(H,90,111)(H,91,104)(H,92,113)(H,93,106)(H,94,107)(H,95,109)(H,99,100)(H,115,116)/t43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,60-,61-,62-/m0/s1
| Molecular Formula | C77H137N19O20S4 |
| Molecular Weight | 1777.287 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 17 / 17 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 11:59:48 GMT 2025
by
admin
on
Wed Apr 02 11:59:48 GMT 2025
|
| Record UNII |
UJ5XJ9TFU9
|
| Record Status |
alternative
|
| Record Version |
|
-
Download
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
Primary Definition |
|