Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 3C32H47O5.Al |
| Molecular Weight | 1562.1193 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 27 / 27 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Al+3].[H][C@@]12C[C@](C)(CC[C@]1(C)CC[C@]3(C)C2=CC(=O)[C@]4([H])[C@@]5(C)CC[C@H](OC(C)=O)C(C)(C)[C@]5([H])CC[C@@]34C)C([O-])=O.[H][C@@]67C[C@](C)(CC[C@]6(C)CC[C@]8(C)C7=CC(=O)[C@]9([H])[C@@]%10(C)CC[C@H](OC(C)=O)C(C)(C)[C@]%10([H])CC[C@@]89C)C([O-])=O.[H][C@@]%11%12C[C@](C)(CC[C@]%11(C)CC[C@]%13(C)C%12=CC(=O)[C@]%14([H])[C@@]%15(C)CC[C@H](OC(C)=O)C(C)(C)[C@]%15([H])CC[C@@]%13%14C)C([O-])=O
InChI
InChIKey=FJVOAGWAAYLCGO-OIODSIPPSA-K
InChI=1S/3C32H48O5.Al/c3*1-19(33)37-24-10-11-30(6)23(27(24,2)3)9-12-32(8)25(30)22(34)17-20-21-18-29(5,26(35)36)14-13-28(21,4)15-16-31(20,32)7;/h3*17,21,23-25H,9-16,18H2,1-8H3,(H,35,36);/q;;;+3/p-3/t3*21-,23-,24-,25+,28+,29-,30-,31+,32+;/m000./s1
| Molecular Formula | Al |
| Molecular Weight | 26.9815 |
| Charge | 3 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C32H47O5 |
| Molecular Weight | 511.7126 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 9 / 9 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 17:16:57 UTC 2023
by
admin
on
Fri Dec 15 17:16:57 UTC 2023
|
| Record UNII |
85RP28F39U
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C29701
Created by
admin on Fri Dec 15 17:16:57 UTC 2023 , Edited by admin on Fri Dec 15 17:16:57 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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268907
Created by
admin on Fri Dec 15 17:16:57 UTC 2023 , Edited by admin on Fri Dec 15 17:16:57 UTC 2023
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PRIMARY | RxNorm | ||
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C98248
Created by
admin on Fri Dec 15 17:16:57 UTC 2023 , Edited by admin on Fri Dec 15 17:16:57 UTC 2023
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PRIMARY | |||
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m1344
Created by
admin on Fri Dec 15 17:16:57 UTC 2023 , Edited by admin on Fri Dec 15 17:16:57 UTC 2023
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PRIMARY | Merck Index | ||
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29728-34-5
Created by
admin on Fri Dec 15 17:16:57 UTC 2023 , Edited by admin on Fri Dec 15 17:16:57 UTC 2023
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PRIMARY | |||
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85RP28F39U
Created by
admin on Fri Dec 15 17:16:57 UTC 2023 , Edited by admin on Fri Dec 15 17:16:57 UTC 2023
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PRIMARY | |||
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76960234
Created by
admin on Fri Dec 15 17:16:57 UTC 2023 , Edited by admin on Fri Dec 15 17:16:57 UTC 2023
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PRIMARY | |||
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249-815-5
Created by
admin on Fri Dec 15 17:16:57 UTC 2023 , Edited by admin on Fri Dec 15 17:16:57 UTC 2023
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PRIMARY | |||
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SUB21866
Created by
admin on Fri Dec 15 17:16:57 UTC 2023 , Edited by admin on Fri Dec 15 17:16:57 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
PARENT -> SALT/SOLVATE |
