Navigation

name Structure Reference Source Properties Activities Metabolism

methyl 18'-methoxy-6',15,25'-trioxa-8,10',19,20'-tetraazaspiro[hexacyclo[10.9.1.0¹,?.0²,?.0¹²,¹?.0¹?,²²]docosane-18,22'-octacyclo[11.10.1.1¹,²¹.1³,¹?.0³,?.0¹?,¹?.0²?,²?.0¹³,²?]hexacosane]-2,4,6,9,14',16',18'-heptaene-10-carboxylate

AlkaPlorer ID: AK014438

Synonym: None

IUPAC Name: methyl (1'S,3'S,12R,18S,21'R,22R,24'R,26'R)-18'-methoxyspiro[15-oxa-8,19-diazahexacyclo[10.9.1.01,9.02,7.012,16.019,22]docosa-2,4,6,9-tetraene-18,22'-6,25-dioxa-10,20-diazaoctacyclo[11.10.1.11,21.13,10.03,7.014,19.020,24.013,26]hexacosa-14(19),15,17-triene]-10-carboxylate

Structure

SMILES: COC(=O)C1=C2NC3=CC=CC=C3C23CCN2[C@H]3[C@]3(CCOC3C[C@@]23C[C@@]24C[C@]56CCOC5CCN5CCC7(C8=CC=CC(OC)=C8N([C@H]72)[C@@H]3O4)[C@@H]56)C1

copy

InChI: InChI=1S/C43H48N4O6/c1-49-28-9-5-7-26-31(28)47-36-41(22-39-14-19-51-29(39)10-15-45-16-11-43(26,36)34(39)45)23-40(37(47)53-41)21-30-38(13-18-52-30)20-24(33(48)50-2)32-42(12-17-46(40)35(38)42)25-6-3-4-8-27(25)44-32/h3-9,29-30,34-37,44H,10-23H2,1-2H3/t29?,30?,34-,35-,36-,37+,38+,39+,40-,41-,42?,43?/m0/s1

copy

InChIKey: MOSOQUZHQBRJPD-QCFQZQTQSA-N

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain
Callichilia barteri Callichilia Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 716.8790000000002

TPSA？: 84.97

MolLogP？: 4.463800000000004

Number of H-Donors: 1

Number of H-Acceptors: 10

RingCount: 14

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information