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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H24N2O3
Molecular Weight 364.4376
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-COLUBRINE

SMILES

[H][C@]12C[C@@]3([H])C4=CCO[C@@]5([H])CC(=O)N6C7=C(C=CC(OC)=C7)[C@@]1(CCN2C4)[C@]6([H])[C@@]35[H]

InChI

InChIKey=CAPUGADOGHKUQS-JPPAUQSISA-N
InChI=1S/C22H24N2O3/c1-26-13-2-3-15-16(8-13)24-19(25)10-17-20-14-9-18-22(15,21(20)24)5-6-23(18)11-12(14)4-7-27-17/h2-4,8,14,17-18,20-21H,5-7,9-11H2,1H3/t14-,17-,18-,20-,21-,22+/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H24N2O3
Molecular Weight 364.4376
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:17:47 GMT 2023
Edited
by admin
on Sat Dec 16 09:17:47 GMT 2023
Record UNII
42R57747MD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-COLUBRINE
MI  
Common Name English
11-METHOXYSTRYCHNINE
Common Name English
STRYCHNIDIN-10-ONE, 3-METHOXY-
Common Name English
.ALPHA.-COLUBRINE [MI]
Common Name English
Code System Code Type Description
CAS
509-44-4
Created by admin on Sat Dec 16 09:17:47 GMT 2023 , Edited by admin on Sat Dec 16 09:17:47 GMT 2023
PRIMARY
EPA CompTox
DTXSID90965139
Created by admin on Sat Dec 16 09:17:47 GMT 2023 , Edited by admin on Sat Dec 16 09:17:47 GMT 2023
PRIMARY
MERCK INDEX
m3744
Created by admin on Sat Dec 16 09:17:47 GMT 2023 , Edited by admin on Sat Dec 16 09:17:47 GMT 2023
PRIMARY Merck Index
PUBCHEM
12303796
Created by admin on Sat Dec 16 09:17:47 GMT 2023 , Edited by admin on Sat Dec 16 09:17:47 GMT 2023
PRIMARY
FDA UNII
42R57747MD
Created by admin on Sat Dec 16 09:17:47 GMT 2023 , Edited by admin on Sat Dec 16 09:17:47 GMT 2023
PRIMARY