Molecule

(1R,18S,33S)-20,25-dimethoxy-8,23-dioxa-15,30-diazaheptacyclo[22.6.2.2⁹,¹².1³,⁷.1¹⁴,¹⁸.0²⁷,³¹.0²²,³³]hexatriaconta-3,5,7(36),9,11,14,19,21,24,26,31,34-dodecaene

AlkaPlorer ID: AK264045

Synonym: None

IUPAC Name: (1R,18S,33S)-20,25-dimethoxy-8,23-dioxa-15,30-diazaheptacyclo[22.6.2.29,12.13,7.114,18.027,31.022,33]hexatriaconta-3(36),4,6,9(35),10,12(34),14,19,21,24,26,31-dodecaene

Structure

SMILES: COC1=C[C@@H]2CCN=C3CC4=CC=C(C=C4)OC4=CC=CC(=C4)C[C@H]4NCCC5=CC(OC)=C(C=C54)OC(=C1)[C@H]32

InChI: InChI=1S/C34H34N2O4/c1-37-27-17-24-11-13-36-30-15-21-6-8-25(9-7-21)39-26-5-3-4-22(14-26)16-29-28-20-32(40-33(19-27)34(24)30)31(38-2)18-23(28)10-12-35-29/h3-9,14,17-20,24,29,34-35H,10-13,15-16H2,1-2H3/t24-,29+,34-/m0/s1

InChIKey: VQSMHQHVINQAFK-SRYFTIFFSA-N

Reference

Bisbenzylisoquinoline alkaloids from Guatteria boliviana (Annonaceae)

PubChem CID: 163020587

LOTUS: LTS0026464

SuperNatural Ⅲ: SN0397543-01

NPASS: NPC206394

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: 534.6560000000004

TPSA？: 61.31

MolLogP？: 6.356800000000007

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 8

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi