Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | 2C22H35O4.Ca |
| Molecular Weight | 767.1 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 10 / 10 |
| E/Z Centers | 4 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].[H][C@]12C\C(C[C@@]1(C)C[C@@H](O)[C@@H]2\C=C\[C@@H](O)CCCCC)=C\CCCC([O-])=O.[H][C@]34C\C(C[C@@]3(C)C[C@@H](O)[C@@H]4\C=C\[C@@H](O)CCCCC)=C\CCCC([O-])=O
InChI
InChIKey=NJTMVDAFPIEZAJ-BMKVUGPNSA-L
InChI=1S/2C22H36O4.Ca/c2*1-3-4-5-9-17(23)11-12-18-19-13-16(8-6-7-10-21(25)26)14-22(19,2)15-20(18)24;/h2*8,11-12,17-20,23-24H,3-7,9-10,13-15H2,1-2H3,(H,25,26);/q;;+2/p-2/b2*12-11+,16-8-;/t2*17-,18+,19+,20+,22-;/m00./s1
Approval Year
| Name | Type | Language | ||
|---|---|---|---|---|
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Official Name | English | ||
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Code | English | ||
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Common Name | English | ||
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Common Name | English | ||
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Common Name | English | ||
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Code | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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C171867
Created by
admin on Fri Dec 15 15:16:37 UTC 2023 , Edited by admin on Fri Dec 15 15:16:37 UTC 2023
|
PRIMARY | |||
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CHEMBL2110886
Created by
admin on Fri Dec 15 15:16:37 UTC 2023 , Edited by admin on Fri Dec 15 15:16:37 UTC 2023
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PRIMARY | |||
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T-100
Created by
admin on Fri Dec 15 15:16:37 UTC 2023 , Edited by admin on Fri Dec 15 15:16:37 UTC 2023
|
PRIMARY | |||
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81703-55-1
Created by
admin on Fri Dec 15 15:16:37 UTC 2023 , Edited by admin on Fri Dec 15 15:16:37 UTC 2023
|
PRIMARY | |||
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9853650
Created by
admin on Fri Dec 15 15:16:37 UTC 2023 , Edited by admin on Fri Dec 15 15:16:37 UTC 2023
|
PRIMARY | |||
|
A85Y5Y98EJ
Created by
admin on Fri Dec 15 15:16:37 UTC 2023 , Edited by admin on Fri Dec 15 15:16:37 UTC 2023
|
PRIMARY |
ACTIVE MOIETY
SUBSTANCE RECORD
