U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H20O2
Molecular Weight 232.3181
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ECHINOPINE A

SMILES

[H][C@@]12C[C@]3([H])[C@@]([H])(CC[C@@]34C[C@@]14CC(O)=O)C(=C)CC2

InChI

InChIKey=XODFJJSIJDSDCR-OGMFBOKVSA-N
InChI=1S/C15H20O2/c1-9-2-3-10-6-12-11(9)4-5-14(12)8-15(10,14)7-13(16)17/h10-12H,1-8H2,(H,16,17)/t10-,11+,12-,14-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H20O2
Molecular Weight 232.3181
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:31:36 GMT 2023
Edited
by admin
on Sat Dec 16 16:31:36 GMT 2023
Record UNII
H0K500KK3D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ECHINOPINE A
Common Name English
2,4-PROPANOCYCLOPROPA(C)PENTALENE-1A(1H)-ACETIC ACID, HEXAHYDRO-7-METHYLENE-, (1AR,2R,3AR,4R,6AR)-
Systematic Name English
(1AR,2R,3AR,4R,6AR)-HEXAHYDRO-7-METHYLENE-2,4-PROPANOCYCLOPROPA(C)PENTALENE-1A(1H)-ACETIC ACID
Systematic Name English
(+)-ECHINOPINE A
Common Name English
ECHINOPINE A [MI]
Common Name English
Code System Code Type Description
PUBCHEM
24809003
Created by admin on Sat Dec 16 16:31:36 GMT 2023 , Edited by admin on Sat Dec 16 16:31:36 GMT 2023
PRIMARY
FDA UNII
H0K500KK3D
Created by admin on Sat Dec 16 16:31:36 GMT 2023 , Edited by admin on Sat Dec 16 16:31:36 GMT 2023
PRIMARY
MERCK INDEX
m11810
Created by admin on Sat Dec 16 16:31:36 GMT 2023 , Edited by admin on Sat Dec 16 16:31:36 GMT 2023
PRIMARY
CAS
1013026-40-8
Created by admin on Sat Dec 16 16:31:36 GMT 2023 , Edited by admin on Sat Dec 16 16:31:36 GMT 2023
PRIMARY