Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C18H25NO5 |
Molecular Weight | 335.3948 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[H][C@]12CCN3CC=C(COC(=O)[C@](C)(O)[C@H](C)C\C(=C/C)C(=O)O1)[C@]23[H]
InChI
InChIKey=HKODIGSRFALUTA-IKZAEVNJSA-N
InChI=1S/C18H25NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4+/t11-,14-,15-,18-/m1/s1
Molecular Formula | C18H25NO5 |
Molecular Weight | 335.3948 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 4 / 4 |
E/Z Centers | 1 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 19:40:16 UTC 2023
by
admin
on
Fri Dec 15 19:40:16 UTC 2023
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Record UNII |
3179A6U4PN
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Record Status |
Validated (UNII)
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Record Version |
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-
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480-79-5
Created by
admin on Fri Dec 15 19:40:16 UTC 2023 , Edited by admin on Fri Dec 15 19:40:16 UTC 2023
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5281733
Created by
admin on Fri Dec 15 19:40:16 UTC 2023 , Edited by admin on Fri Dec 15 19:40:16 UTC 2023
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DTXSID601016480
Created by
admin on Fri Dec 15 19:40:16 UTC 2023 , Edited by admin on Fri Dec 15 19:40:16 UTC 2023
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79540
Created by
admin on Fri Dec 15 19:40:16 UTC 2023 , Edited by admin on Fri Dec 15 19:40:16 UTC 2023
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m9860
Created by
admin on Fri Dec 15 19:40:16 UTC 2023 , Edited by admin on Fri Dec 15 19:40:16 UTC 2023
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PRIMARY | Merck Index | ||
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3179A6U4PN
Created by
admin on Fri Dec 15 19:40:16 UTC 2023 , Edited by admin on Fri Dec 15 19:40:16 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> CONSTITUENT ALWAYS PRESENT |
Butterbur root alkaloid.
|