Molecule

Ebeietinone

AlkaPlorer ID: AK081797

Synonym: ''

IUPAC Name: (3S,5S,8S,9S,10R,13S,14S,17R)-3,5-dihydroxy-10,13-dimethyl-17-[(1S)-1-[(3S)-3-methyl-2,3,4,5-tetrahydropyridin-6-yl]ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-one

Structure

SMILES: C[C@H]1CCC([C@@H](C)[C@H]2CC[C@H]3[C@@H]4CC(=O)[C@]5(O)C[C@@H](O)CC[C@]5(C)[C@H]4CC[C@]23C)=NC1

InChI: InChI=1S/C27H43NO3/c1-16-5-8-23(28-15-16)17(2)20-6-7-21-19-13-24(30)27(31)14-18(29)9-12-26(27,4)22(19)10-11-25(20,21)3/h16-22,29,31H,5-15H2,1-4H3/t16-,17-,18-,19-,20+,21-,22-,25+,26+,27+/m0/s1

InChIKey: OXSDZAAZDQVKSD-OZZCYSRFSA-N

Reference

A steroidal alkaloid from Fritillaria ebeiensis

PubChem CID: 5316982

LOTUS: LTS0198088

SuperNatural Ⅲ: SN0278001-03

NPASS: NPC254506

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Kielmeyera argentea	Kielmeyera	Calophyllaceae	Malpighiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Fritillaria ebeiensis	Fritillaria	Liliaceae	Liliales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Corydalis caseana	Corydalis	Papaveraceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Chione venosa	Chione	Rubiaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Garcinia yunnanensis	Garcinia	Clusiaceae	Malpighiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Ichnocarpus frutescens	Ichnocarpus	Apocynaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Rhytisma fulvum	Rhytisma	Alcyoniidae	Malacalcyonacea	Anthozoa	Cnidaria	Metazoa	Eukaryota
Anabaena torulosa	Anabaena	Nostocaceae	Nostocales	Cyanophyceae	Cyanobacteriota	None	Bacteria

Properties Information

Molecule Weight: 429.64500000000027

TPSA？: 69.89

MolLogP？: 4.807100000000005

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi