Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C36H42N2O9 |
| Molecular Weight | 646.7267 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(N(CC2=CC=C(OCCN3CCCCCC3)C=C2)C4=CC=C(O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O)C=C14)C6=CC=C(O)C=C6
InChI
InChIKey=PAAXRVKIJQNQMY-VNOFEJHXSA-N
InChI=1S/C36H42N2O9/c1-22-28-20-27(46-36-33(42)31(40)32(41)34(47-36)35(43)44)14-15-29(28)38(30(22)24-8-10-25(39)11-9-24)21-23-6-12-26(13-7-23)45-19-18-37-16-4-2-3-5-17-37/h6-15,20,31-34,36,39-42H,2-5,16-19,21H2,1H3,(H,43,44)/t31-,32-,33+,34-,36+/m0/s1
| Molecular Formula | C36H42N2O9 |
| Molecular Weight | 646.7267 |
| 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 15:54:55 GMT 2023
by
admin
on
Sat Dec 16 15:54:55 GMT 2023
|
| Record UNII |
Z271JQC8WY
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Code System | Code | Type | Description | ||
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328933-56-8
Created by
admin on Sat Dec 16 15:54:55 GMT 2023 , Edited by admin on Sat Dec 16 15:54:55 GMT 2023
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Z271JQC8WY
Created by
admin on Sat Dec 16 15:54:55 GMT 2023 , Edited by admin on Sat Dec 16 15:54:55 GMT 2023
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9895767
Created by
admin on Sat Dec 16 15:54:55 GMT 2023 , Edited by admin on Sat Dec 16 15:54:55 GMT 2023
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DTXSID80432461
Created by
admin on Sat Dec 16 15:54:55 GMT 2023 , Edited by admin on Sat Dec 16 15:54:55 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
MAJOR
PLASMA
|
