Spiradine C
AlkaPlorer ID: AK039435
Synonym: ''
IUPAC Name: [(16S)-16-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecan-19-yl] acetate
Structure
SMILES: C=C1CC23C[C@]4(O)C5C6(C)CCCC57C(C2CC1C(OC(C)=O)C37)N4C6
InChI: InChI=1S/C22H29NO3/c1-11-8-20-9-22(25)18-19(3)5-4-6-21(18)16(20)15(26-12(2)24)13(11)7-14(20)17(21)23(22)10-19/h13-18,25H,1,4-10H2,2-3H3/t13?,14?,15?,16?,17?,18?,19?,20?,21?,22-/m0/s1
InChIKey: DWUXLTHMRXTVCJ-RDWLVGASSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Spiraea japonica | Spiraea | Rosaceae | Rosales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 355.47800000000007
TPSA？: 49.77
MolLogP？: 2.7132000000000005
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 9
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|