Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H37NO9 |
| Molecular Weight | 519.584 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 5 / 5 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@@]12OC3=C(O)C=CC4=C3[C@@]15CCN(CC=C)[C@H](C4)[C@]5(O)CC[C@@H]2OCCOCCOCCOCC(O)=O
InChI
InChIKey=CKIMPNYBEIGDOE-ZVHMEQHSSA-N
InChI=1S/C27H37NO9/c1-2-8-28-9-7-26-23-18-3-4-19(29)24(23)37-25(26)20(5-6-27(26,32)21(28)16-18)36-15-14-34-11-10-33-12-13-35-17-22(30)31/h2-4,20-21,25,29,32H,1,5-17H2,(H,30,31)/t20-,21+,25-,26-,27+/m0/s1
| Molecular Formula | C27H37NO9 |
| Molecular Weight | 519.584 |
| 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 15:11:09 GMT 2023
by
admin
on
Sat Dec 16 15:11:09 GMT 2023
|
| Record UNII |
2ZU68V975P
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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2ZU68V975P
Created by
admin on Sat Dec 16 15:11:09 GMT 2023 , Edited by admin on Sat Dec 16 15:11:09 GMT 2023
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2194602-16-7
Created by
admin on Sat Dec 16 15:11:09 GMT 2023 , Edited by admin on Sat Dec 16 15:11:09 GMT 2023
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156596519
Created by
admin on Sat Dec 16 15:11:09 GMT 2023 , Edited by admin on Sat Dec 16 15:11:09 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |
FECAL; URINE
|
