Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H27O2S.I |
| Molecular Weight | 434.375 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[I-].C[S+](C)CCOC(=O)[C@H](C1CCCCC1)C2=CC=CC=C2
InChI
InChIKey=LZXCSAFKUYXBTJ-LMOVPXPDSA-M
InChI=1S/C18H27O2S.HI/c1-21(2)14-13-20-18(19)17(15-9-5-3-6-10-15)16-11-7-4-8-12-16;/h3,5-6,9-10,16-17H,4,7-8,11-14H2,1-2H3;1H/q+1;/p-1/t17-;/m0./s1
| Molecular Formula | C18H27O2S |
| Molecular Weight | 307.471 |
| Charge | 1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | HI |
| Molecular Weight | 127.91241 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 23:07:09 GMT 2025
by
admin
on
Mon Mar 31 23:07:09 GMT 2025
|
| Record UNII |
BCR33TL4OQ
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Common Name | English | ||
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Preferred Name | English |
| Code System | Code | Type | Description | ||
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76959488
Created by
admin on Mon Mar 31 23:07:09 GMT 2025 , Edited by admin on Mon Mar 31 23:07:09 GMT 2025
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PRIMARY | |||
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BCR33TL4OQ
Created by
admin on Mon Mar 31 23:07:09 GMT 2025 , Edited by admin on Mon Mar 31 23:07:09 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
