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

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 .BETA.-COLUBRINE

SMILES

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

InChI

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

HIDE SMILES / InChI

Approval Year

Name Type Language
.BETA.-COLUBRINE
MI  
Common Name English
STRYCHNIDIN-10-ONE, 2-METHOXY-
Common Name English
10-METHOXYSTRYCHNINE
Common Name English
NSC-72862
Code English
.BETA.-COLUBRINE [MI]
Common Name English
2-METHOXYSTRYCHNIDIN-10-ONE
Common Name English
Code System Code Type Description
FDA UNII
PEK2HDB6QQ
Created by admin on Sat Dec 16 09:46:13 GMT 2023 , Edited by admin on Sat Dec 16 09:46:13 GMT 2023
PRIMARY
CAS
509-36-4
Created by admin on Sat Dec 16 09:46:13 GMT 2023 , Edited by admin on Sat Dec 16 09:46:13 GMT 2023
PRIMARY
NSC
72862
Created by admin on Sat Dec 16 09:46:13 GMT 2023 , Edited by admin on Sat Dec 16 09:46:13 GMT 2023
PRIMARY
MERCK INDEX
m3744
Created by admin on Sat Dec 16 09:46:13 GMT 2023 , Edited by admin on Sat Dec 16 09:46:13 GMT 2023
PRIMARY Merck Index
PUBCHEM
251890
Created by admin on Sat Dec 16 09:46:13 GMT 2023 , Edited by admin on Sat Dec 16 09:46:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID301031421
Created by admin on Sat Dec 16 09:46:13 GMT 2023 , Edited by admin on Sat Dec 16 09:46:13 GMT 2023
PRIMARY
CHEBI
132697
Created by admin on Sat Dec 16 09:46:13 GMT 2023 , Edited by admin on Sat Dec 16 09:46:13 GMT 2023
PRIMARY