3-hydroxy-3-methyl-2-[6-(3-methylbut-2-en-1-yl)-1H-indol-3-yl]butyl hexadecanoate
AlkaPlorer ID: AK124320
Synonym: None
IUPAC Name: [(2S)-3-hydroxy-3-methyl-2-[6-(3-methylbut-2-enyl)-1H-indol-3-yl]butyl] hexadecanoate
Structure
SMILES: CCCCCCCCCCCCCCCC(=O)OC[C@H](C1=CNC2=CC(CC=C(C)C)=CC=C12)C(C)(C)O
InChI: InChI=1S/C34H55NO3/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-33(36)38-26-31(34(4,5)37)30-25-35-32-24-28(21-20-27(2)3)22-23-29(30)32/h20,22-25,31,35,37H,6-19,21,26H2,1-5H3/t31-/m1/s1
InChIKey: WJKJRPLMXNXGSG-WJOKGBTCSA-N
Reference
New Di-isoprenylated Indole Derivatives from Hexalobus crispiflorus
PubChem CID: 163064056
LOTUS: LTS0088819
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hexalobus crispiflorus | Hexalobus | Annonaceae | Magnoliales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 525.8180000000003
TPSA？: 62.32000000000001
MolLogP？: 9.555599999999998
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|