Delsoline
AlkaPlorer ID: AK000439
Synonym: None
IUPAC Name: (1S,4S,5R,6S,8R,9S,10S,13S,16S,18S)-11-ethyl-4,6,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-8,9,16-triol
Structure
SMILES: CCN1C[C@@]2(CC[C@@H]([C@]34[C@H]1[C@]([C@H](C23)OC)([C@]5(C[C@@H]([C@H]6CC4C5[C@H]6OC)OC)O)O)O)COC
InChI: InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18+,19?,20+,21+,22+,23-,24+,25-/m1/s1
InChIKey: JVBLTQQBEQQLEV-LPHVGPHASA-N
Source
Properties Information
Molecule Weight: 467.60300000000024
TPSA？: 100.85000000000001
MolLogP？: 0.27100000000000296
Number of H-Donors: 3
Number of H-Acceptors: 8
RingCount: 6
Activities Information
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