5-carbamimidamidopentyl (5R,9S,10R)-7-amino-9-undecyl-1-oxa-6,8-diazaspiro[4.5]dec-7-ene-10-carboxylate
AlkaPlorer ID: AK155112
Synonym: None
IUPAC Name: 5-(diaminomethylideneamino)pentyl (5R,6R,7S)-9-amino-7-undecyl-1-oxa-8,10-diazaspiro[4.5]dec-8-ene-6-carboxylate
Structure
SMILES: CCCCCCCCCCC[C@@H]1NC(=N)N[C@@]2(CCCO2)[C@@H]1C(=O)OCCCCCNC(=N)N
InChI: InChI=1S/C25H48N6O3/c1-2-3-4-5-6-7-8-9-11-15-20-21(25(16-14-19-34-25)31-24(28)30-20)22(32)33-18-13-10-12-17-29-23(26)27/h20-21H,2-19H2,1H3,(H4,26,27,29)(H3,28,30,31)/t20-,21-,25+/m0/s1
InChIKey: IYTLITMPOLVVNA-STWLZBDKSA-N
Reference
Two new guanidine alkaloids from the mediterranean sponge crambe crambe.
PubChem CID: 162897589
LOTUS: LTS0109325
SuperNatural Ⅲ: SN0158938-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Crambe crambe | Crambe (in: sponges) | Crambeidae | Poecilosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 480.6980000000004
TPSA？: 145.34000000000003
MolLogP？: 3.722940000000002
Number of H-Donors: 6
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|