Molecule

Ficuseptine C

AlkaPlorer ID: AK061018

Synonym: '', 'ficuseptine C'

IUPAC Name: (23R)-13-methoxy-5,7-dioxa-19-azahexacyclo[15.7.0.02,10.04,8.011,16.019,23]tetracosa-1(17),2,4(8),9,11(16),12,14-heptaene

Structure

SMILES: COC1=CC=C2C3=C(C[C@H]4CCCN4C3)C3=CC4=C(C=C3C2=C1)OCO4

InChI: InChI=1S/C22H21NO3/c1-24-14-4-5-15-17(8-14)19-10-22-21(25-12-26-22)9-18(19)16-7-13-3-2-6-23(13)11-20(15)16/h4-5,8-10,13H,2-3,6-7,11-12H2,1H3/t13-/m1/s1

InChIKey: SQVBRXGPXHOUAI-CYBMUJFWSA-N

Reference

Phenanthroindolizidine Alkaloids from the Stems of <i>Ficus septica</i>

PubChem CID: 11359996

LOTUS: LTS0175343

SuperNatural Ⅲ: SN0352898-01

NPASS: NPC76079

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Nandina domestica	Nandina	Berberidaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Bryonia cretica	Bryonia	Cucurbitaceae	Cucurbitales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Parmelia omphalodes	Parmelia	Parmeliaceae	Lecanorales	Lecanoromycetes	Ascomycota	Fungi	Eukaryota
Isertia hypoleuca	Isertia	Rubiaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Dimetia capitellata	Dimetia	Rubiaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 347.4140000000001

TPSA？: 30.930000000000003

MolLogP？: 4.250800000000004

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 6

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Homo sapiens	CCRF-CEM	GI50	323.0	nM	10.1016/j.bmcl.2007.11.054
Homo sapiens	PANC-1	GI50	156.0	nM	10.1016/j.bmcl.2007.11.054
None	NON-PROTEIN TARGET	GI50	371.0	nM	10.1016/j.bmcl.2007.11.054
None	Unchecked	Activity	nan	None	10.1016/j.bmcl.2007.11.054
None	Unchecked	IC50	1244.0	nM	10.1016/j.bmcl.2007.11.054
None	Unchecked	IC50	2440.0	nM	10.1016/j.bmcl.2007.11.054
None	Unchecked	IC50	2566.0	nM	10.1016/j.bmcl.2007.11.054
None	Unchecked	IC50	3383.0	nM	10.1016/j.bmcl.2007.11.054