(1S,8S,10R,15R,22S,29R)-10-methyl-9,30-dioxa-11,25-diazapentacyclo[20.6.2.2⁸,¹¹.0¹⁰,¹⁵.0²⁵,²⁹]dotriacontan-1-ol
AlkaPlorer ID: AK223377
Synonym: None
IUPAC Name: (1S,8S,10R,15R,22S,29R)-10-methyl-9,30-dioxa-11,25-diazapentacyclo[20.6.2.28,11.010,15.025,29]dotriacontan-1-ol
Structure
SMILES: C[C@@]12O[C@H]3CCCCCC[C@]4(O)CCCN5CC[C@H](CCCCCC[C@@H]1CCCN2CC3)O[C@@H]54
InChI: InChI=1S/C29H52N2O3/c1-28-24-12-6-2-3-7-14-25-16-22-30-20-11-19-29(32,27(30)33-25)18-9-5-4-8-15-26(34-28)17-23-31(28)21-10-13-24/h24-27,32H,2-23H2,1H3/t24-,25+,26+,27-,28-,29+/m1/s1
InChIKey: WUPBCHMPCIYJCM-VRZSYJHESA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Neopetrosia chaliniformis | Neopetrosia | Petrosiidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 476.7460000000005
TPSA？: 45.17
MolLogP？: 5.840200000000007
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|