Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C35H36N2O14 |
| Molecular Weight | 708.6653 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC=C(OC(=O)N(CC(O)=O)CC2=CC=C(OCCC3=C(C)OC(=N3)C4=CC=C(O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O)C=C4)C=C2)C=C1
InChI
InChIKey=PWNFGKRXZIMIIL-WKRHDJAJSA-N
InChI=1S/C35H36N2O14/c1-19-26(36-32(48-19)21-5-9-24(10-6-21)49-34-30(42)28(40)29(41)31(51-34)33(43)44)15-16-47-23-7-3-20(4-8-23)17-37(18-27(38)39)35(45)50-25-13-11-22(46-2)12-14-25/h3-14,28-31,34,40-42H,15-18H2,1-2H3,(H,38,39)(H,43,44)/t28-,29-,30+,31-,34+/m0/s1
| Molecular Formula | C35H36N2O14 |
| Molecular Weight | 708.6653 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 16:38:43 GMT 2023
by
admin
on
Sat Dec 16 16:38:43 GMT 2023
|
| Record UNII |
BN70G7Y291
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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BN70G7Y291
Created by
admin on Sat Dec 16 16:38:43 GMT 2023 , Edited by admin on Sat Dec 16 16:38:43 GMT 2023
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146675083
Created by
admin on Sat Dec 16 16:38:43 GMT 2023 , Edited by admin on Sat Dec 16 16:38:43 GMT 2023
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886984-58-3
Created by
admin on Sat Dec 16 16:38:43 GMT 2023 , Edited by admin on Sat Dec 16 16:38:43 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
PLASMA, BILE
|
