(9S,15R,17S)-6-hydroxy-5-methoxy-2,18-dioxa-10-azapentacyclo[20.2.2.1⁹,¹⁷.0³,⁸.0¹⁰,¹⁵]heptacosa-1(24),3(8),4,6,22,25-hexaen-19-one
AlkaPlorer ID: AK162431
Synonym: None
IUPAC Name: (9S,15R,17S)-6-hydroxy-5-methoxy-2,18-dioxa-10-azapentacyclo[20.2.2.19,17.03,8.010,15]heptacosa-1(24),3,5,7,22,25-hexaen-19-one
Structure
SMILES: COC1=CC2=C(C=C1O)[C@@H]1C[C@H](C[C@H]3CCCCN31)OC(=O)CCC1=CC=C(C=C1)O2
InChI: InChI=1S/C25H29NO5/c1-29-24-15-23-20(14-22(24)27)21-13-19(12-17-4-2-3-11-26(17)21)31-25(28)10-7-16-5-8-18(30-23)9-6-16/h5-6,8-9,14-15,17,19,21,27H,2-4,7,10-13H2,1H3/t17-,19+,21+/m1/s1
InChIKey: BNZQLMXVMRJEMM-LMNJBCLMSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Decodon verticillatus | Decodon | Lythraceae | Myrtales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 423.5090000000002
TPSA？: 68.23
MolLogP？: 4.740500000000004
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|