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Details

Stereochemistry ABSOLUTE
Molecular Formula C36H51NO12
Molecular Weight 689.7896
Optical Activity UNSPECIFIED
Defined Stereocenters 14 / 14
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PSEUDOACONITINE

SMILES

CCN1C[C@@]2(COC)[C@H]3[C@@H](OC)[C@H]4[C@@H]1[C@@]3([C@@H]5C[C@@]6(O)[C@H](OC(=O)C7=CC=C(OC)C(OC)=C7)[C@@H]5[C@@]4(C[C@@H]6OC)OC(C)=O)[C@H](C[C@H]2O)OC

InChI

InChIKey=YVPYMQHYESYLIR-HZKWNRCISA-N
InChI=1S/C36H51NO12/c1-9-37-16-33(17-42-3)23(39)13-24(45-6)36-20-14-34(41)25(46-7)15-35(49-18(2)38,27(30(36)37)28(47-8)29(33)36)26(20)31(34)48-32(40)19-10-11-21(43-4)22(12-19)44-5/h10-12,20,23-31,39,41H,9,13-17H2,1-8H3/t20-,23-,24+,25+,26-,27+,28+,29-,30-,31-,33+,34+,35-,36+/m1/s1

HIDE SMILES / InChI

Molecular Formula C36H51NO12
Molecular Weight 689.7896
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 14 / 14
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Flowers of evil.
2010-11-06
Overdose effect of aconite containing Ayurvedic Medicine ('Mahashankha Vati').
2010-07
Mesaconitine.
2008-05-10
Gene duplication of coagulation factor V and origin of venom prothrombin activator in Pseudonaja textilis snake.
2005-03
Novel products from oxidation of the norditerpenoid alkaloid pseudaconine with HIO4.
2001-06
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:54:07 GMT 2025
Edited
by admin
on Mon Mar 31 22:54:07 GMT 2025
Record UNII
5483BY72RT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACRACONITINE
Preferred Name English
PSEUDOACONITINE
MI  
Common Name English
PSEUDOACONITINE [MI]
Common Name English
NEPAUL ACONITINE
Common Name English
ACONITANE-3,8,13,14-TETROL, 20-ETHYL-1,6,16-TRIMETHOXY-4-(METHOXYMETHYL)-, 8-ACETATE 14-(3,4-DIMETHOXYBENZOATE), (1.ALPHA.,3.ALPHA.,6.ALPHA.,14.ALPHA.,16.BETA.)-
Systematic Name English
FERACONITINE
Common Name English
PSEUDACONITINE
Common Name English
NEPALINE
Common Name English
Code System Code Type Description
FDA UNII
5483BY72RT
Created by admin on Mon Mar 31 22:54:07 GMT 2025 , Edited by admin on Mon Mar 31 22:54:07 GMT 2025
PRIMARY
EPA CompTox
DTXSID90894011
Created by admin on Mon Mar 31 22:54:07 GMT 2025 , Edited by admin on Mon Mar 31 22:54:07 GMT 2025
PRIMARY
MERCK INDEX
m440
Created by admin on Mon Mar 31 22:54:07 GMT 2025 , Edited by admin on Mon Mar 31 22:54:07 GMT 2025
PRIMARY Merck Index
CAS
1369-10-4
Created by admin on Mon Mar 31 22:54:07 GMT 2025 , Edited by admin on Mon Mar 31 22:54:07 GMT 2025
SUPERSEDED
PUBCHEM
90478913
Created by admin on Mon Mar 31 22:54:07 GMT 2025 , Edited by admin on Mon Mar 31 22:54:07 GMT 2025
PRIMARY
WIKIPEDIA
Pseudaconitine
Created by admin on Mon Mar 31 22:54:07 GMT 2025 , Edited by admin on Mon Mar 31 22:54:07 GMT 2025
PRIMARY
CAS
127-29-7
Created by admin on Mon Mar 31 22:54:07 GMT 2025 , Edited by admin on Mon Mar 31 22:54:07 GMT 2025
PRIMARY