Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C27H45NO3.ClHO4 |
| Molecular Weight | 532.11 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 13 / 13 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OCl(=O)(=O)=O.[H][C@@]12CC[C@@]3([H])[C@@]([H])(CN4C[C@@H](C)CC[C@@]4([H])[C@@]3(C)O)[C@]1([H])C[C@@]5([H])[C@@]2([H])C[C@H](O)[C@@]6([H])C[C@@H](O)CC[C@]56C
InChI
InChIKey=BVEBDMUQRHSRLN-LOGDSNHLSA-N
InChI=1S/C27H45NO3.ClHO4/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2;2-1(3,4)5/h15-25,29-31H,4-14H2,1-3H3;(H,2,3,4,5)/t15-,16-,17+,18+,19-,20-,21-,22-,23+,24-,25-,26+,27-;/m0./s1
| Molecular Formula | ClHO4 |
| Molecular Weight | 100.459 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C27H45NO3 |
| Molecular Weight | 431.6511 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 13 / 13 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:44:19 GMT 2023
by
admin
on
Sat Dec 16 10:44:19 GMT 2023
|
| Record UNII |
2J402604TU
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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90478464
Created by
admin on Sat Dec 16 10:44:20 GMT 2023 , Edited by admin on Sat Dec 16 10:44:20 GMT 2023
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m11435
Created by
admin on Sat Dec 16 10:44:20 GMT 2023 , Edited by admin on Sat Dec 16 10:44:20 GMT 2023
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PRIMARY | Merck Index | ||
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2J402604TU
Created by
admin on Sat Dec 16 10:44:20 GMT 2023 , Edited by admin on Sat Dec 16 10:44:20 GMT 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
