Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C48H71N15O18S |
| Molecular Weight | 1178.232 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC2=CNC=N2)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CSCC(=O)NCCCC[C@H](N)C(O)=O)C(O)=O
InChI
InChIKey=KXMXYKOMUIVPBN-GUJNWKEGSA-N
InChI=1S/C48H71N15O18S/c1-24(57-40(72)28(50)18-37(67)68)39(71)58-30(12-13-36(65)66)42(74)60-31(16-25-8-3-2-4-9-25)43(75)59-29(11-7-15-55-48(51)52)41(73)61-32(17-26-20-53-23-56-26)44(76)62-33(19-38(69)70)45(77)63-34(47(80)81)21-82-22-35(64)54-14-6-5-10-27(49)46(78)79/h2-4,8-9,20,23-24,27-34H,5-7,10-19,21-22,49-50H2,1H3,(H,53,56)(H,54,64)(H,57,72)(H,58,71)(H,59,75)(H,60,74)(H,61,73)(H,62,76)(H,63,77)(H,65,66)(H,67,68)(H,69,70)(H,78,79)(H,80,81)(H4,51,52,55)/t24-,27-,28-,29-,30-,31-,32-,33-,34-/m0/s1
| Molecular Formula | C48H71N15O18S |
| Molecular Weight | 1178.232 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 2 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 01:06:13 GMT 2023
by
admin
on
Sat Dec 16 01:06:13 GMT 2023
|
| Record UNII |
W5Y3KOX4Y9
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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91618027
Created by
admin on Sat Dec 16 01:06:13 GMT 2023 , Edited by admin on Sat Dec 16 01:06:13 GMT 2023
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PRIMARY | |||
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W5Y3KOX4Y9
Created by
admin on Sat Dec 16 01:06:13 GMT 2023 , Edited by admin on Sat Dec 16 01:06:13 GMT 2023
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PRIMARY |