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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H40N2O
Molecular Weight 372.5872
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HOLARRHENINE

SMILES

[H][C@]12CC[C@@]3([H])[C@]4([H])CC=C5C[C@H](CC[C@]5(C)[C@@]4([H])C[C@@H](O)[C@]13CN(C)[C@H]2C)N(C)C

InChI

InChIKey=QESDNCVYXJTJRY-NFKVXLAQSA-N
InChI=1S/C24H40N2O/c1-15-19-8-9-20-18-7-6-16-12-17(25(3)4)10-11-23(16,2)21(18)13-22(27)24(19,20)14-26(15)5/h6,15,17-22,27H,7-14H2,1-5H3/t15-,17-,18-,19+,20-,21-,22+,23-,24+/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H40N2O
Molecular Weight 372.5872
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:45:21 GMT 2023
Edited
by admin
on Sat Dec 16 08:45:21 GMT 2023
Record UNII
T3M9HB3VDU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HOLARRHENINE
MI  
Common Name English
(3.BETA.,12.BETA.)-3-(DIMETHYLAMINO)CON-5-ENIN-12-OL
Systematic Name English
12.BETA.-HYDROXYCONESSINE
Common Name English
CON-5-ENIN-12-OL, 3-(DIMETHYLAMINO)-, (3.BETA.,12.BETA.)-
Systematic Name English
HOLARRHENINE [MI]
Common Name English
Code System Code Type Description
CAS
561-22-8
Created by admin on Sat Dec 16 08:45:21 GMT 2023 , Edited by admin on Sat Dec 16 08:45:21 GMT 2023
PRIMARY
PUBCHEM
12310556
Created by admin on Sat Dec 16 08:45:21 GMT 2023 , Edited by admin on Sat Dec 16 08:45:21 GMT 2023
PRIMARY
FDA UNII
T3M9HB3VDU
Created by admin on Sat Dec 16 08:45:21 GMT 2023 , Edited by admin on Sat Dec 16 08:45:21 GMT 2023
PRIMARY
MERCK INDEX
m235
Created by admin on Sat Dec 16 08:45:21 GMT 2023 , Edited by admin on Sat Dec 16 08:45:21 GMT 2023
PRIMARY Merck Index