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Details

Stereochemistry ACHIRAL
Molecular Formula 2C11H19O2.Ca
Molecular Weight 406.613
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CALCIUM UNDECYLENATE

SMILES

[Ca++].[O-]C(=O)CCCCCCCCC=C.[O-]C(=O)CCCCCCCCC=C

InChI

InChIKey=CLOKKBBIKHZGNX-UHFFFAOYSA-L
InChI=1S/2C11H20O2.Ca/c2*1-2-3-4-5-6-7-8-9-10-11(12)13;/h2*2H,1,3-10H2,(H,12,13);/q;;+2/p-2

HIDE SMILES / InChI
Molecular Formula C11H19O2
Molecular Weight 183.2674
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
Molecular Formula Ca
Molecular Weight 40.078
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Unknown
86413
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:11:55 UTC 2023
Edited
by admin
on Fri Dec 15 15:11:55 UTC 2023
Record UNII
77YW1RTU8V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CALCIUM UNDECYLENATE
INCI   USAN   USP  
INCI   USAN  
Official Name English
CALCIUM UNDECENOATE
MART.   WHO-DD  
Systematic Name English
UNDECYLENATE CALCIUM
VANDF  
Common Name English
CALCIUM UNDECENOATE [MART.]
Common Name English
CRUEX
Brand Name English
Calcium 10-undecenoate
Systematic Name English
UNDECYLENATE CALCIUM [VANDF]
Common Name English
CALCIUM UNDECYLENATE [INCI]
Common Name English
CALCIUM UNDECYLENATE [USAN]
Common Name English
Calcium undecenoate [WHO-DD]
Common Name English
CALCIUM UNDECYLENATE [USP MONOGRAPH]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C514
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
CFR 21 CFR 333.210
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
Code System Code Type Description
DRUG BANK
DB15678
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
DAILYMED
77YW1RTU8V
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
CAS
1322-14-1
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
PUBCHEM
14865
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
EPA CompTox
DTXSID6057742
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
RS_ITEM_NUM
1087450
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
ECHA (EC/EINECS)
215-331-8
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
SMS_ID
100000132592
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
NCI_THESAURUS
C75199
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
FDA UNII
77YW1RTU8V
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
ChEMBL
CHEMBL2104130
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
EVMPD
SUB47776
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY
RXCUI
89746
Created by admin on Fri Dec 15 15:11:55 UTC 2023 , Edited by admin on Fri Dec 15 15:11:55 UTC 2023
PRIMARY RxNorm
Related Record Type Details
Structure of UNDECYLENIC ACID
PARENT -> SALT/SOLVATE
NIH
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