protostemonine

AlkaPlorer ID: AK053412

Synonym: '', 'Isoprotostemonine', 'Protostemonine'

IUPAC Name: (5Z)-4-methoxy-3-methyl-5-[(1S,2R,3S,6R,11S)-3-methyl-11-[(2S,4S)-4-methyl-5-oxooxolan-2-yl]-5-oxa-10-azatricyclo[8.3.0.02,6]tridecan-4-ylidene]furan-2-one

Structure

SMILES: COC1=C(C)C(=O)O/C1=C1\O[C@@H]2CCCN3[C@@H](CC[C@H]3[C@@H]3C[C@H](C)C(=O)O3)[C@H]2[C@@H]1C

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InChI: InChI=1S/C23H31NO6/c1-11-10-17(29-22(11)25)14-7-8-15-18-12(2)20(28-16(18)6-5-9-24(14)15)21-19(27-4)13(3)23(26)30-21/h11-12,14-18H,5-10H2,1-4H3/b21-20-/t11-,12-,14-,15-,16+,17-,18+/m0/s1

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InChIKey: JDGNFRYDHRYXNL-ROHJGGRPSA-N

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Reference

Alkaloids of Stemona japonica

PubChem CID: 25256772

CAS: 27495-40-5

LOTUS: LTS0231069

data_source: manually

Source

Species Genus Family Order Class Phylum Kingdom Domain
Stemona kerrii Stemona Stemonaceae Pandanales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 417.5020000000002

TPSA: 74.30000000000001

MolLogP: 2.904700000000001

Number of H-Donors: 0

Number of H-Acceptors: 7

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information