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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H45NO4
Molecular Weight 447.6505
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of STEVALADIL

SMILES

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@@]4([H])C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12COC(C)=O)N(C)C)[C@H](C)OC(C)=O

InChI

InChIKey=AYSBIMSATXNCSF-VFEFFJNBSA-N
InChI=1S/C27H45NO4/c1-17(32-19(3)30)23-9-10-25-22-8-7-20-15-21(28(5)6)11-13-26(20,4)24(22)12-14-27(23,25)16-31-18(2)29/h17,20-25H,7-16H2,1-6H3/t17-,20-,21-,22+,23+,24-,25-,26-,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H45NO4
Molecular Weight 447.6505
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Stevaladil is a pregnanediol derivative patented by Shionogi & Co., Ltd. as antiparasitic agent

Originator

Sources: JP40023018; "Selective partial reduction of carda-​14,​16,​20(22)​-​trienolide"; Sato, Daisuke; Wada, Takayuki

Approval Year

PubMed

PubMed

TitleDatePubMed
Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:57:58 GMT 2023
Edited
by admin
on Fri Dec 15 16:57:58 GMT 2023
Record UNII
FW24343731
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
STEVALADIL
INN  
INN  
Official Name English
stevaladil [INN]
Common Name English
3.BETA.-(DIMETHYLAMINO)-5.ALPHA.-PREGNANE-18,20.ALPHA.-DIOL DIACETATE (ESTER)
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29707
Created by admin on Fri Dec 15 16:57:58 GMT 2023 , Edited by admin on Fri Dec 15 16:57:58 GMT 2023
Code System Code Type Description
SMS_ID
100000083836
Created by admin on Fri Dec 15 16:57:58 GMT 2023 , Edited by admin on Fri Dec 15 16:57:58 GMT 2023
PRIMARY
NCI_THESAURUS
C91006
Created by admin on Fri Dec 15 16:57:58 GMT 2023 , Edited by admin on Fri Dec 15 16:57:58 GMT 2023
PRIMARY
CAS
6535-03-1
Created by admin on Fri Dec 15 16:57:58 GMT 2023 , Edited by admin on Fri Dec 15 16:57:58 GMT 2023
PRIMARY
INN
3847
Created by admin on Fri Dec 15 16:57:58 GMT 2023 , Edited by admin on Fri Dec 15 16:57:58 GMT 2023
PRIMARY
FDA UNII
FW24343731
Created by admin on Fri Dec 15 16:57:58 GMT 2023 , Edited by admin on Fri Dec 15 16:57:58 GMT 2023
PRIMARY
PUBCHEM
92215571
Created by admin on Fri Dec 15 16:57:58 GMT 2023 , Edited by admin on Fri Dec 15 16:57:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID801018137
Created by admin on Fri Dec 15 16:57:58 GMT 2023 , Edited by admin on Fri Dec 15 16:57:58 GMT 2023
PRIMARY
ChEMBL
CHEMBL2104465
Created by admin on Fri Dec 15 16:57:58 GMT 2023 , Edited by admin on Fri Dec 15 16:57:58 GMT 2023
PRIMARY
EVMPD
SUB10647MIG
Created by admin on Fri Dec 15 16:57:58 GMT 2023 , Edited by admin on Fri Dec 15 16:57:58 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY