Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C45H83N23O14S2 |
| Molecular Weight | 1234.416 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](C)NC(=O)[C@@H](CSSC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O)NC(C)=O)C(=O)N[C@H](CCCNC(N)=N)C(N)=O
InChI
InChIKey=YMANZFUJXRVEOX-VSZUPWKTSA-N
InChI=1S/C45H83N23O14S2/c1-21(34(74)65-25(33(47)73)8-4-14-56-42(48)49)61-37(77)26(9-5-15-57-43(50)51)67-39(79)28(11-7-17-59-45(54)55)68-38(78)27(10-6-16-58-44(52)53)66-35(75)22(2)62-40(80)30(63-23(3)69)20-84-83-19-29(36(76)60-18-32(71)72)64-31(70)13-12-24(46)41(81)82/h21-22,24-30H,4-20,46H2,1-3H3,(H2,47,73)(H,60,76)(H,61,77)(H,62,80)(H,63,69)(H,64,70)(H,65,74)(H,66,75)(H,67,79)(H,68,78)(H,71,72)(H,81,82)(H4,48,49,56)(H4,50,51,57)(H4,52,53,58)(H4,54,55,59)/t21-,22-,24+,25-,26-,27-,28-,29+,30-/m1/s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
|
Code | English | ||
|
Code | English | ||
|
Systematic Name | English | ||
|
Code | English | ||
|
Common Name | English | ||
|
Systematic Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
156613900
Created by
admin on Sat Dec 16 13:44:34 GMT 2023 , Edited by admin on Sat Dec 16 13:44:34 GMT 2023
|
PRIMARY | |||
|
62UB4Z963Y
Created by
admin on Sat Dec 16 13:44:34 GMT 2023 , Edited by admin on Sat Dec 16 13:44:34 GMT 2023
|
PRIMARY |
PARENT (METABOLITE LESS ACTIVE)
SUBSTANCE RECORD
