STEVALADIL

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 Search

SMILES

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

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

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/15781398 | Chimica Therapeutica (1970), 5, (2), 129-37.

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

Originator

Approval Year

PubMed

Title	Date	PubMed
Atom, atom-type, and total nonstochastic and stochastic quadratic fingerprints: a promising approach for modeling of antibacterial activity.	2005-04-15	15781398

Patents

Name

Type

Language

STEVALADIL

Official Name

English

3.BETA.-(DIMETHYLAMINO)-5.ALPHA.-PREGNANE-18,20.ALPHA.-DIOL DIACETATE (ESTER)

Preferred Name

English

stevaladil [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29707