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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H39NO7
Molecular Weight 453.569
Optical Activity UNSPECIFIED
Defined Stereocenters 13 / 13
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DELCOSINE

SMILES

[H][C@@]12C[C@@H]3[C@]([H])([C@H]1O)[C@](O)(C[C@@H]2OC)[C@@]4(O)[C@@H](OC)[C@@]5([H])[C@]36C4N(CC)C[C@]5(COC)CC[C@@H]6O

InChI

InChIKey=BMZNJVXOLCBDPZ-FCXNFKKQSA-N
InChI=1S/C24H39NO7/c1-5-25-10-21(11-30-2)7-6-15(26)23-13-8-12-14(31-3)9-22(28,16(13)17(12)27)24(29,20(23)25)19(32-4)18(21)23/h12-20,26-29H,5-11H2,1-4H3/t12-,13-,14+,15+,16-,17+,18-,19+,20+,21+,22-,23+,24-/m1/s1

HIDE SMILES / InChI

Molecular Formula C24H39NO7
Molecular Weight 453.569
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 13
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:54:37 GMT 2023
Edited
by admin
on Sat Dec 16 09:54:37 GMT 2023
Record UNII
310MTB41FE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DELCOSINE
MI  
Common Name English
TAKAO BASE I
Common Name English
DELCOSIN
Common Name English
DELCOSINE [MI]
Common Name English
(1.ALPHA.,6.BETA.,14.ALPHA.,16.BETA.)-20-ETHYL-6,16-DIMETHOXY-4-(METHOXYMETHYL)ACONITANE-1,7,8,14-TETROL
Systematic Name English
LUCACONINE
Common Name English
ACONITANE-1,7,8,14-TETROL, 20-ETHYL-6,16-DIMETHOXY-4-(METHOXYMETHYL)-, (1.ALPHA.,6.BETA.,14.ALPHA.,16.BETA.)-
Common Name English
ILIENSINE
Common Name English
DELPHAMINE
Common Name English
Code System Code Type Description
FDA UNII
310MTB41FE
Created by admin on Sat Dec 16 09:54:37 GMT 2023 , Edited by admin on Sat Dec 16 09:54:37 GMT 2023
PRIMARY
EPA CompTox
DTXSID501318592
Created by admin on Sat Dec 16 09:54:37 GMT 2023 , Edited by admin on Sat Dec 16 09:54:37 GMT 2023
PRIMARY
CAS
545-56-2
Created by admin on Sat Dec 16 09:54:37 GMT 2023 , Edited by admin on Sat Dec 16 09:54:37 GMT 2023
PRIMARY
PUBCHEM
57525180
Created by admin on Sat Dec 16 09:54:37 GMT 2023 , Edited by admin on Sat Dec 16 09:54:37 GMT 2023
PRIMARY
MERCK INDEX
m4157
Created by admin on Sat Dec 16 09:54:37 GMT 2023 , Edited by admin on Sat Dec 16 09:54:37 GMT 2023
PRIMARY Merck Index