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

Details

Stereochemistry ABSOLUTE
Molecular Formula C36H38N2O6
Molecular Weight 594.6967
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BEBEERINE

SMILES

[H][C@]12CC3=CC=C(OC4=C5C(CCN(C)[C@@]5([H])CC6=CC=C(O)C(OC7=CC1=C(CCN2C)C=C7OC)=C6)=CC(OC)=C4O)C=C3

InChI

InChIKey=NGZXDRGWBULKFA-NSOVKSMOSA-N
InChI=1S/C36H38N2O6/c1-37-13-11-23-18-31(41-3)32-20-26(23)27(37)15-21-5-8-25(9-6-21)43-36-34-24(19-33(42-4)35(36)40)12-14-38(2)28(34)16-22-7-10-29(39)30(17-22)44-32/h5-10,17-20,27-28,39-40H,11-16H2,1-4H3/t27-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula C36H38N2O6
Molecular Weight 594.6967
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:06:10 GMT 2023
Edited
by admin
on Sat Dec 16 09:06:10 GMT 2023
Record UNII
01MDR0WU2J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BEBEERINE
MI  
Common Name English
NECTANDRINE
Brand Name English
13H-4,6:21,24-DIETHENO-8,12-METHENO-1H-PYRIDO(3',2':14,15)(1,11)DIOXACYCLOEICOSINO(2,3,4-IJ)ISOQUINOLINE-9,19-DIOL, 2,3,13A,14,15,16,25,25A-OCTAHYDRO-18,29-DIMETHOXY-1,14-DIMETHYL-, (13AS,25AS)-
Systematic Name English
TUBOCURARAN-7',12'-DIOL, 6,6'-DIMETHOXY-2,2'-DIMETHYL-, (1'.ALPHA.)-
Common Name English
(13AS,25AS)-2,3,13A,14,15,16,25,25A-OCTAHYDRO-18,29-DIMETHOXY-1,14-DIMETHYL-13H-4,6:21,24-DIETHENO-8,12-METHENO-1H-PYRIDO(3',2':14,15)(1,11)-DIOXACYCLO-EICOSINO(2,3,4-IJ)ISOQUINOLINE-9,19-DIOL
Systematic Name English
CHONDRODENDRINE
Common Name English
D-BEBEERINE
Common Name English
BEBEERINE [MI]
Common Name English
PELOSINE
Common Name English
Code System Code Type Description
CAS
477-60-1
Created by admin on Sat Dec 16 09:06:10 GMT 2023 , Edited by admin on Sat Dec 16 09:06:10 GMT 2023
PRIMARY
FDA UNII
01MDR0WU2J
Created by admin on Sat Dec 16 09:06:10 GMT 2023 , Edited by admin on Sat Dec 16 09:06:10 GMT 2023
PRIMARY
MERCK INDEX
m2284
Created by admin on Sat Dec 16 09:06:10 GMT 2023 , Edited by admin on Sat Dec 16 09:06:10 GMT 2023
PRIMARY Merck Index
EPA CompTox
DTXSID80963907
Created by admin on Sat Dec 16 09:06:10 GMT 2023 , Edited by admin on Sat Dec 16 09:06:10 GMT 2023
PRIMARY
PUBCHEM
12300019
Created by admin on Sat Dec 16 09:06:10 GMT 2023 , Edited by admin on Sat Dec 16 09:06:10 GMT 2023
PRIMARY