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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H15NO3.H2O
Molecular Weight 203.2356
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ECGONINE MONOHYDRATE

SMILES

O.CN1[C@H]2CC[C@@H]1[C@H]([C@@H](O)C2)C(O)=O

InChI

InChIKey=UGPQWACOCBWXEC-PXXJPSRFSA-N
InChI=1S/C9H15NO3.H2O/c1-10-5-2-3-6(10)8(9(12)13)7(11)4-5;/h5-8,11H,2-4H2,1H3,(H,12,13);1H2/t5-,6+,7-,8+;/m0./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
ECGONINE MONOHYDRATE
MI  
Common Name English
ECGONINE MONOHYDRATE [MI]
Common Name English
(1R,2R,3S,5S)-3-HYDROXY-8-METHYL-8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLIC ACID MONOHYDRATE
Systematic Name English
8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLIC ACID, 3-HYDROXY-8-METHYL-, MONOHYDRATE, (1R-(EXO,EXO))-
Systematic Name English
Code System Code Type Description
MERCK INDEX
m4810
Created by admin on Fri Dec 15 15:47:27 UTC 2023 , Edited by admin on Fri Dec 15 15:47:27 UTC 2023
PRIMARY Merck Index
PUBCHEM
70269372
Created by admin on Fri Dec 15 15:47:27 UTC 2023 , Edited by admin on Fri Dec 15 15:47:27 UTC 2023
PRIMARY
FDA UNII
ET3PMG0528
Created by admin on Fri Dec 15 15:47:27 UTC 2023 , Edited by admin on Fri Dec 15 15:47:27 UTC 2023
PRIMARY
CAS
5796-30-5
Created by admin on Fri Dec 15 15:47:27 UTC 2023 , Edited by admin on Fri Dec 15 15:47:27 UTC 2023
PRIMARY