(1S,2S,7S,10R,11S,14S,15R,16S,17S,18S,20S,23S)-7-hydroxy-10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁵,²³.0¹⁷,²²]tetracos-4-en-18-yl acetate
AlkaPlorer ID: AK243773
Synonym: None
IUPAC Name: [(1S,2S,7S,10R,11S,14S,15R,16S,17S,18S,20S,23S)-7-hydroxy-10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.02,11.05,10.015,23.017,22]tetracos-4-en-18-yl] acetate
Structure
SMILES: CC(=O)O[C@H]1C[C@H](C)CN2[C@H]1[C@@H](C)[C@H]1[C@@H]2C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
InChI: InChI=1S/C29H45NO3/c1-16-12-25(33-18(3)31)27-17(2)26-24(30(27)15-16)14-23-21-7-6-19-13-20(32)8-10-28(19,4)22(21)9-11-29(23,26)5/h6,16-17,20-27,32H,7-15H2,1-5H3/t16-,17-,20-,21+,22-,23-,24-,25-,26-,27-,28-,29-/m0/s1
InChIKey: ZZYWILWDFCFHLX-VHHDHVISSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Solanum chacoense | Solanum | Solanaceae | Solanales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 455.6830000000004
TPSA？: 49.77
MolLogP？: 5.196600000000005
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|