Molecule

UNPD23284

AlkaPlorer ID: AK259239

Synonym: None

IUPAC Name: 2-[3-[(1R,5R)-5-[5-[2-(dimethylamino)ethyl]-2-methoxyphenyl]-3-methyl-6-propan-2-ylidenecyclohex-3-en-1-yl]-4-methoxyphenyl]-N,N-dimethylethanamine

Structure

SMILES: COC1=CC=C(CCN(C)C)C=C1[C@@H]1C=C(C)C[C@@H](C2=CC(CCN(C)C)=CC=C2OC)C1=C(C)C

InChI: InChI=1S/C32H46N2O2/c1-22(2)32-28(26-20-24(14-16-33(4)5)10-12-30(26)35-8)18-23(3)19-29(32)27-21-25(15-17-34(6)7)11-13-31(27)36-9/h10-13,18,20-21,28-29H,14-17,19H2,1-9H3/t28-,29-/m0/s1

InChIKey: LLYGNRFRSDDNEH-VMPREFPWSA-N

Reference

Bishordeninyl terpene alkaloids and other constituents of Zanthoxylum culantrillo and Z. coriaceum

PubChem CID: 162939082

LOTUS: LTS0269540

SuperNatural Ⅲ: SN0209161-01

NPASS: NPC163048

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Smyrnium perfoliatum	Smyrnium	Apiaceae	Apiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Tuberolachnus salignus	Tuberolachnus	Aphididae	Hemiptera	Insecta	Arthropoda	Metazoa	Eukaryota
Artocarpus odoratissimus	Artocarpus	Moraceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Commiphora kua	Commiphora	Burseraceae	Sapindales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Leontodon filii	Leontodon	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 490.7320000000004

TPSA？: 24.94

MolLogP？: 6.465800000000008

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi