Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C31H40N8O4S |
| Molecular Weight | 620.766 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC(N(C)CCN(C)C)=C(NC(=O)CCSC[C@H](N)C(O)=O)C=C1NC2=NC(=CC=N2)C3=CN(C)C4=C3C=CC=C4
InChI
InChIKey=XGWSQKKLNKMHKG-QFIPXVFZSA-N
InChI=1S/C31H40N8O4S/c1-37(2)13-14-38(3)27-17-28(43-5)25(16-24(27)34-29(40)11-15-44-19-22(32)30(41)42)36-31-33-12-10-23(35-31)21-18-39(4)26-9-7-6-8-20(21)26/h6-10,12,16-18,22H,11,13-15,19,32H2,1-5H3,(H,34,40)(H,41,42)(H,33,35,36)/t22-/m0/s1
| Molecular Formula | C31H40N8O4S |
| Molecular Weight | 620.766 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 02:38:23 GMT 2025
by
admin
on
Wed Apr 02 02:38:23 GMT 2025
|
| Record UNII |
NL4G273UPN
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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Preferred Name | English | ||
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Systematic Name | English |
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155929082
Created by
admin on Wed Apr 02 02:38:23 GMT 2025 , Edited by admin on Wed Apr 02 02:38:23 GMT 2025
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PRIMARY | |||
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NL4G273UPN
Created by
admin on Wed Apr 02 02:38:23 GMT 2025 , Edited by admin on Wed Apr 02 02:38:23 GMT 2025
|
PRIMARY |
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PARENT -> METABOLITE |
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