Tetrahydroxybacteriohopane Glucosamine
AlkaPlorer ID: AK320152
Synonym: None
IUPAC Name: 7-(5a,5b,8,8,11a,13b-hexamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysen-3-yl)-1-[3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctane-2,3,4-triol
Structure
SMILES: CC(CCC(O)C(O)C(O)COC1OC(CO)C(O)C(O)C1N)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C
InChI: InChI=1S/C41H73NO8/c1-23(9-10-26(44)33(46)27(45)22-49-36-32(42)35(48)34(47)28(21-43)50-36)24-13-18-38(4)25(24)14-19-40(6)30(38)11-12-31-39(5)17-8-16-37(2,3)29(39)15-20-41(31,40)7/h23-36,43-48H,8-22,42H2,1-7H3
InChIKey: BDUDNTRWKFDSBE-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Methylobacterium organophilum | Methylobacterium | Methylobacteriaceae | Hyphomicrobiales | Alphaproteobacteria | Pseudomonadota | None | Bacteria |
| Burkholderia cenocepacia | Burkholderia | Burkholderiaceae | Burkholderiales | Betaproteobacteria | Pseudomonadota | None | Bacteria |
Properties Information
Molecule Weight: 708.0339999999998
TPSA？: 165.86
MolLogP？: 4.759800000000003
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|