Caldarchaeol; O-(2-Aminoethylphosphoryl)
AlkaPlorer ID: AK291426
Synonym: Caldarchaetidylethanolamine
IUPAC Name: 2-aminoethyl [38-(hydroxymethyl)-7,11,15,19,22,26,30,34,43,47,51,55,58,62,66,70-hexadecamethyl-1,4,37,40-tetraoxacyclodoheptacont-2-yl]methyl hydrogen phosphate
Structure
SMILES: CC1CCCC(C)CCCC(C)CCC(C)CCCC(C)CCCC(C)CCCC(C)CCOC(COP(=O)(O)OCCN)COCCC(C)CCCC(C)CCCC(C)CCCC(C)CCC(C)CCCC(C)CCCC(C)CCCC(C)CCOC(CO)COCCC(C)CCC1
InChI: InChI=1S/C88H178NO9P/c1-71-29-17-33-75(5)41-25-49-83(13)57-62-93-68-87(67-90)95-64-59-85(15)51-27-43-77(7)35-19-31-73(3)39-23-47-81(11)55-53-80(10)46-22-38-72(2)30-18-34-76(6)42-26-50-84(14)58-63-94-69-88(70-98-99(91,92)97-66-61-89)96-65-60-86(16)52-28-44-78(8)36-20-32-74(4)40-24-48-82(12)56-54-79(9)45-21-37-71/h71-88,90H,17-70,89H2,1-16H3,(H,91,92)
InChIKey: ZJNYDPNHEYDDCA-UHFFFAOYSA-N
Reference
CAS: 108766-38-7
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Methanobacterium | Methanobacteriaceae | Methanobacteriales | Methanobacteria | Euryarchaeota | None | Archaea |
Properties Information
Molecule Weight: 1425.3639999999996
TPSA？: 138.93
MolLogP？: 26.230200000000053
Number of H-Donors: 3
Number of H-Acceptors: 9
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|