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Details

Stereochemistry RACEMIC
Molecular Formula C16H16N2O2
Molecular Weight 268.3104
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of RUGULOVASINE A

SMILES

CN[C@H]1CC2=CNC3=C2C(=CC=C3)[C@@]14OC(=O)C(C)=C4

InChI

InChIKey=QTWQJTORJVFWAQ-XJKSGUPXSA-N
InChI=1S/C16H16N2O2/c1-9-7-16(20-15(9)19)11-4-3-5-12-14(11)10(8-18-12)6-13(16)17-2/h3-5,7-8,13,17-18H,6H2,1-2H3/t13-,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H16N2O2
Molecular Weight 268.3104
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 Fri Dec 15 19:51:33 GMT 2023
Edited
by admin
on Fri Dec 15 19:51:33 GMT 2023
Record UNII
90DEE096C5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RUGULOVASINE A
MI  
Common Name English
SPIRO(BENZ(CD)INDOLE-5(1H),2'(5'H)-FURAN)-5'-ONE, 3,4-DIHYDRO-4'-METHYL-4-(METHYLAMINO)-, CIS-(±)-
Common Name English
PIRO(BENZ(CD)INDOLE-5(1H),2'(5'H)-FURAN)-5'-ONE, 3,4-DIHYDRO-4'-METHYL-4-(METHYLAMINO)-, (2'R,4S)-REL-
Common Name English
SPIRO(BENZ(CD)INDOLE-5(1H),2'(5'H)-FURAN)-5'-ONE, 3,4-DIHYDRO-4'-METHYL-4-(METHYLAMINO)-, CIS-
Common Name English
RUGULOVASINE A [MI]
Common Name English
Code System Code Type Description
CAS
26909-33-1
Created by admin on Fri Dec 15 19:51:33 GMT 2023 , Edited by admin on Fri Dec 15 19:51:33 GMT 2023
PRIMARY
FDA UNII
90DEE096C5
Created by admin on Fri Dec 15 19:51:33 GMT 2023 , Edited by admin on Fri Dec 15 19:51:33 GMT 2023
PRIMARY
EPA CompTox
DTXSID20949700
Created by admin on Fri Dec 15 19:51:33 GMT 2023 , Edited by admin on Fri Dec 15 19:51:33 GMT 2023
PRIMARY
PUBCHEM
115153
Created by admin on Fri Dec 15 19:51:33 GMT 2023 , Edited by admin on Fri Dec 15 19:51:33 GMT 2023
PRIMARY
MERCK INDEX
m9698
Created by admin on Fri Dec 15 19:51:33 GMT 2023 , Edited by admin on Fri Dec 15 19:51:33 GMT 2023
PRIMARY Merck Index