Molecule

Funiferine

AlkaPlorer ID: AK064462

Synonym: None

IUPAC Name: (1R,14S)-6,20,21,25-tetramethoxy-15,30-dimethyl-23-oxa-15,30-diazaheptacyclo[22.6.2.13,7.18,12.114,18.027,31.022,33]pentatriaconta-3(35),4,6,8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol

Structure

SMILES: COC1=CC2=C3C=C1OC1=C4C(=CC(OC)=C1OC)CCN(C)[C@H]4CC1=CC=C(O)C(=C1)C1=CC(=CC=C1OC)C[C@H]3N(C)CC2

InChI: InChI=1S/C38H42N2O6/c1-39-13-11-24-19-33(43-4)34-21-26(24)29(39)17-23-8-10-32(42-3)28(16-23)27-15-22(7-9-31(27)41)18-30-36-25(12-14-40(30)2)20-35(44-5)37(45-6)38(36)46-34/h7-10,15-16,19-21,29-30,41H,11-14,17-18H2,1-6H3/t29-,30+/m1/s1

InChIKey: ODCYIKWOTVSPKB-IHLOFXLRSA-N

Reference

Bisbenzylisoquinoline alkaloids from Guatteria boliviana (Annonaceae)

PubChem CID: 70692876

LOTUS: LTS0194696

SuperNatural Ⅲ: SN0262183-01

NPASS: NPC16357

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Croptilon divaricatum	Croptilon	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Mephitis mephitis	Mephitis	Mephitidae	Carnivora	Mammalia	Chordata	Metazoa	Eukaryota
Caulerpa prolifera	Caulerpa	Caulerpaceae	Bryopsidales	Ulvophyceae	Chlorophyta	Viridiplantae	Eukaryota
Tabernaemontana divaricata	Tabernaemontana	Apocynaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Taraxacum linearisquameum	Taraxacum	Asteraceae	Asterales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Myxine glutinosa	Myxine	Myxinidae	Myxiniformes	Myxini	Chordata	Metazoa	Eukaryota
Euscaphis japonica	Euscaphis	Staphyleaceae	Crossosomatales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 622.762

TPSA？: 72.86

MolLogP？: 6.742700000000009

Number of H-Donors: 1

Number of H-Acceptors: 8

RingCount: 7

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Entamoeba histolytica	Entamoeba histolytica	IC50	28.3	ug.mL-1	10.1007/s00044-011-9767-1
Homo sapiens	U-937	Activity	94.0	%	10.1016/j.bmc.2012.06.017
Homo sapiens	U-937	FC	2.5	None	10.1016/j.bmc.2012.06.017
Homo sapiens	U-937	IC50	50000.0	nM	10.1016/j.bmc.2012.06.017
Homo sapiens	U-937	MED	12.0	uM	10.1016/j.bmc.2012.06.017