Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C35H47N5O14 |
| Molecular Weight | 761.7728 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12CC3=C(C=C(NC(=O)CNC(C)(C)C)C(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)=C3C(=O)C1=C(O)[C@]5(O)C(=O)C(C(N)=O)=C(O)[C@H](N(C)C)[C@]5([H])C2)N(C)C
InChI
InChIKey=JGJKQJNAUCEALV-FYYJDNQRSA-N
InChI=1S/C35H47N5O14/c1-34(2,3)37-11-17(41)38-15-10-16(39(4)5)13-8-12-9-14-21(40(6)7)23(43)20(31(36)49)30(48)35(14,52)29(47)18(12)22(42)19(13)27(15)53-33-26(46)24(44)25(45)28(54-33)32(50)51/h10,12,14,21,24-26,28,33,37,43-47,52H,8-9,11H2,1-7H3,(H2,36,49)(H,38,41)(H,50,51)/t12-,14-,21+,24-,25-,26+,28-,33+,35-/m0/s1
| Molecular Formula | C35H47N5O14 |
| Molecular Weight | 761.7728 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:03:55 GMT 2023
by
admin
on
Sat Dec 16 09:03:55 GMT 2023
|
| Record UNII |
63Y3VCE252
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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63Y3VCE252
Created by
admin on Sat Dec 16 09:03:55 GMT 2023 , Edited by admin on Sat Dec 16 09:03:55 GMT 2023
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886219-67-6
Created by
admin on Sat Dec 16 09:03:55 GMT 2023 , Edited by admin on Sat Dec 16 09:03:55 GMT 2023
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54713592
Created by
admin on Sat Dec 16 09:03:55 GMT 2023 , Edited by admin on Sat Dec 16 09:03:55 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
MINOR
FECAL; PLASMA
|
