29-(1,2,3,4,5-Pentahydroxypentyl)-29-hopanol; (22S,29R,31R,32R,33S,34S)-form, 35-O-[2-Deoxy-2-[(9-cyclohexylnonanoyl)amino]-β-D-mannopyranoside]
AlkaPlorer ID: AK309711
Synonym: None
IUPAC Name: None
Structure
SMILES: CC(C(O)C(O)C(O)C(O)C(O)COC1OC(CO)C(O)C(O)C1NC(=O)CCCCCCCCC1CCCCC1)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C
InChI: InChI=1S/C56H99NO11/c1-34(36-24-29-53(4)37(36)25-30-55(6)41(53)22-23-42-54(5)28-17-27-52(2,3)40(54)26-31-56(42,55)7)45(61)49(65)50(66)46(62)38(59)33-67-51-44(48(64)47(63)39(32-58)68-51)57-43(60)21-16-11-9-8-10-13-18-35-19-14-12-15-20-35/h34-42,44-51,58-59,61-66H,8-33H2,1-7H3,(H,57,60)
InChIKey: XWMMWFQSVZPMKM-UHFFFAOYSA-N
Reference
CAS: 1344738-90-4
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Alicyclobacillus acidoterrestris | Alicyclobacillus | Alicyclobacillaceae | Bacillales | Bacilli | Bacillota | None | Bacteria |
Properties Information
Molecule Weight: 962.403999999999
TPSA？: 209.4
MolLogP？: 7.560000000000008
Number of H-Donors: 9
Number of H-Acceptors: 11
RingCount: 7
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|