Molecule

Caracurine V

AlkaPlorer ID: AK291623

Synonym: None

IUPAC Name: 10,30-dioxa-8,15,28,35-tetrazatridecacyclo[33.5.2.215,21.01,36.02,7.08,40.09,19.013,18.016,21.020,28.022,27.029,39.033,38]tetratetraconta-2,4,6,12,22,24,26,32-octaene

Structure

SMILES: C1=C2CN3CCC45C6=CC=CC=C6N6C7OCC=C8CN9CCC%10%11C%12=CC=CC=C%12N(C(OC1)C(C2CC34)C65)C%10C7C8CC9%11

InChI: InChI=1S/C38H40N4O2/c1-3-7-27-25(5-1)37-11-13-39-19-21-10-16-44-36-31(23(21)17-29(37)39)33(37)41(27)35-32-24-18-30-38(12-14-40(30)20-22(24)9-15-43-35)26-6-2-4-8-28(26)42(36)34(32)38/h1-10,23-24,29-36H,11-20H2

InChIKey: CIRUUTNLDXXBKU-UHFFFAOYSA-N

Reference

A Chromatographie Comparison of Strychnos dolichothyrsa and Strychnos urceolata

PubChem CID: 5088395

CAS: 630-87-5

LOTUS: LTS0072875

NPASS: NPC27056

COCONUT: CNP0136714.4

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Strychnos angolensis	Strychnos	Loganiaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Strychnos toxifera	Strychnos	Loganiaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Strychnos chrysophylla	Strychnos	Loganiaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Strychnos afzelii	Strychnos	Loganiaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 584.7640000000004

TPSA？: 31.420000000000005

MolLogP？: 4.266600000000004

Number of H-Donors: 0

Number of H-Acceptors: 6

RingCount: 13

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi