Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C49H69N13O12S |
| Molecular Weight | 1064.217 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NCCCC[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N2C[C@H](O)C[C@H]2C(=O)NCC(=O)N[C@@H](C3CC4=C(C3)C=CC=C4)C(=O)N[C@@H](CO)C(=O)N[C@@H]5CSC6=C(C=CC=C6)N(CC(O)=O)C5=O
InChI
InChIKey=DSKXSKYPLRUWNI-QSFUMIHFSA-N
InChI=1S/C49H69N13O12S/c50-16-6-5-11-31(51)42(68)56-32(12-7-17-54-49(52)53)46(72)60-18-8-14-36(60)48(74)61-23-30(64)21-37(61)44(70)55-22-39(65)59-41(29-19-27-9-1-2-10-28(27)20-29)45(71)57-33(25-63)43(69)58-34-26-75-38-15-4-3-13-35(38)62(47(34)73)24-40(66)67/h1-4,9-10,13,15,29-34,36-37,41,63-64H,5-8,11-12,14,16-26,50-51H2,(H,55,70)(H,56,68)(H,57,71)(H,58,69)(H,59,65)(H,66,67)(H4,52,53,54)/t30-,31+,32+,33+,34-,36+,37+,41+/m1/s1
| Molecular Formula | C49H69N13O12S |
| Molecular Weight | 1064.217 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 8 / 8 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 22:05:54 GMT 2025
by
admin
on
Mon Mar 31 22:05:54 GMT 2025
|
| Record UNII |
8PY38JSG1Y
|
| Record Status |
Validated (UNII)
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| Record Version |
|
-
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76331576
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8PY38JSG1Y
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284037-77-0
Created by
admin on Mon Mar 31 22:05:54 GMT 2025 , Edited by admin on Mon Mar 31 22:05:54 GMT 2025
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