Molecule

Ancistrobrevine B; 1,2-Didehydro, 6-Me ether

AlkaPlorer ID: AK287878

Synonym: Ancistrotanzanine B

IUPAC Name: 5-(4,5-dimethoxy-7-methylnaphthalen-1-yl)-6,8-dimethoxy-1,3-dimethyl-3,4-dihydroisoquinoline

Structure

SMILES: COC1=CC(OC)=C(C2=CC=C(OC)C3=C(OC)C=C(C)C=C23)C2=C1C(C)=NC(C)C2

InChI: InChI=1S/C26H29NO4/c1-14-10-18-17(8-9-20(28-4)26(18)21(11-14)29-5)25-19-12-15(2)27-16(3)24(19)22(30-6)13-23(25)31-7/h8-11,13,15H,12H2,1-7H3

InChIKey: MIMNIDIHOQDTFD-UHFFFAOYSA-N

Reference

Ancistrotanzanine A, the First 5,3‘-Coupled Naphthylisoquinoline Alkaloid, and Two Further, 5,8‘-Linked Related Compounds from the Newly Described Species<i>Ancistrocladus tanzaniensis</i><sup>,1</sup>

PubChem CID: 21589700

CAS: 303752-18-3

LOTUS: LTS0246628

COCONUT: CNP0153909.2

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Ancistrocladus likoko	Ancistrocladus	Ancistrocladaceae	Caryophyllales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 419.5210000000002

TPSA？: 49.28

MolLogP？: 5.603220000000007

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi