methyl (1R,2S,10S,15Z,16S,17R,18S)-18-(acetyloxy)-15-ethylidene-3-methyl-19-oxa-3,13-diazahexacyclo[14.3.1.0²,¹⁰.0²,¹³.0⁴,⁹.0¹⁰,¹⁷]icosa-4(9),5,7-triene-17-carboxylate
AlkaPlorer ID: AK374341
Synonym: None
IUPAC Name: methyl (1R,2S,10S,15E,16S,17R,18R)-18-acetyloxy-15-ethylidene-3-methyl-19-oxa-3,13-diazahexacyclo[14.3.1.02,10.02,13.04,9.010,17]icosa-4,6,8-triene-17-carboxylate
Structure
SMILES: C/C=C1/CN2CC[C@@]34C5=CC=CC=C5N(C)[C@@]23[C@H]2C[C@@H]1[C@]4(C(=O)OC)[C@@H](OC(C)=O)O2
InChI: InChI=1S/C24H28N2O5/c1-5-15-13-26-11-10-22-16-8-6-7-9-18(16)25(3)24(22,26)19-12-17(15)23(22,20(28)29-4)21(31-19)30-14(2)27/h5-9,17,19,21H,10-13H2,1-4H3/b15-5-/t17-,19+,21-,22-,23-,24-/m0/s1
InChIKey: FCGKYGRIKFLOBO-LZWSQBQUSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hunteria umbellata | Hunteria | Apocynaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 424.4970000000002
TPSA？: 68.31
MolLogP？: 2.2034
Number of H-Donors: 0
Number of H-Acceptors: 7
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|