Molecule

2-O-acetylbulbisine Trifluoroacetic acid

AlkaPlorer ID: AK014193

Synonym: '', '1-Epideacetylbowdensine'

IUPAC Name: [(1S,13R,16S,17R)-17-hydroxy-9-methoxy-5,7-dioxa-12-azapentacyclo[10.5.2.01,13.02,10.04,8]nonadeca-2,4(8),9-trien-16-yl] acetate

Structure

SMILES: COC1=C2CN3CC[C@@]4(C2=CC2=C1OCO2)[C@@H](O)[C@@H](OC(C)=O)CC[C@@H]34

InChI: InChI=1S/C19H23NO6/c1-10(21)26-13-3-4-15-19(18(13)22)5-6-20(15)8-11-12(19)7-14-17(16(11)23-2)25-9-24-14/h7,13,15,18,22H,3-6,8-9H2,1-2H3/t13-,15+,18-,19-/m0/s1

InChIKey: DTTIPGMCFAKXCP-UAFONNFLSA-N

Reference

Alkaloids from Crinum macowanii

PubChem CID: 56928078

LOTUS: LTS0252765

SuperNatural Ⅲ: SN0075215-01

NPASS: NPC93658

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Crinum asiaticum	Crinum	Amaryllidaceae	Asparagales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Crotalaria crispata	Crotalaria	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Atriplex parvifolia	Atriplex	Chenopodiaceae	Caryophyllales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Hesperocyparis arizonica	Hesperocyparis	Cupressaceae	Cupressales	Pinopsida	Streptophyta	Viridiplantae	Eukaryota
Artemisia juncea	Artemisia	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Crinum macowanii	Crinum	Amaryllidaceae	Asparagales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Viburnum lantana	Viburnum	Adoxaceae	Dipsacales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 361.3940000000002

TPSA？: 77.46000000000001

MolLogP？: 1.336

Number of H-Donors: 1

Number of H-Acceptors: 7

RingCount: 5

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi