(2S,10R,11R)-10-(3,4-dimethoxyphenyl)-2-hydroxy-4,6-dimethoxy-11-phenyl-9-oxa-14,19-diazapentacyclo[10.7.0.0²,¹⁰.0³,⁸.0¹⁴,¹⁸]nonadeca-1(12),3(8),4,6,18-pentaen-13-one
AlkaPlorer ID: AK231704
Synonym: None
IUPAC Name: (2S,10R,11R)-10-(3,4-dimethoxyphenyl)-2-hydroxy-4,6-dimethoxy-11-phenyl-9-oxa-14,19-diazapentacyclo[10.7.0.02,10.03,8.014,18]nonadeca-1(12),3(8),4,6,18-pentaen-13-one
Structure
SMILES: COC1=CC(OC)=C2C(=C1)O[C@@]1(C3=CC=C(OC)C(OC)=C3)[C@H](C3=CC=CC=C3)C3=C(N=C4CCCN4C3=O)[C@@]21O
InChI: InChI=1S/C32H30N2O7/c1-37-20-16-23(40-4)28-24(17-20)41-32(19-12-13-21(38-2)22(15-19)39-3)27(18-9-6-5-7-10-18)26-29(31(28,32)36)33-25-11-8-14-34(25)30(26)35/h5-7,9-10,12-13,15-17,27,36H,8,11,14H2,1-4H3/t27-,31+,32+/m1/s1
InChIKey: IKRLRGRXCAFTKP-DUQIMVFOSA-N
Reference
Cytotoxic Cyclopenta[<i>b</i>]benzofuran Derivatives from the Stem Bark of <i>Aglaia formosana</i>
PubChem CID: 101133815
LOTUS: LTS0044927
SuperNatural Ⅲ: SN0148184-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aglaia elaeagnoidea | Aglaia | Meliaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 554.5990000000004
TPSA？: 101.27
MolLogP？: 3.8932000000000015
Number of H-Donors: 1
Number of H-Acceptors: 9
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|