32,33,34,35-Bacteriohopanetetrol; (21βH,32R,33R,34S)-form, 35-Deoxy, 35-(N-8Z-hexadecenoylamino) 

AlkaPlorer ID: AK290105

Synonym: N-cis-Palmitoleylaminobacteriohopanetriol 

IUPAC Name: None

Structure

SMILES: CCCCCCC/C=C\CCCCCCC(=O)NCC(O)C(O)C(O)CCC(C)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C

copy

InChI: InChI=1S/C51H91NO4/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-23-45(55)52-36-41(54)46(56)40(53)25-24-37(2)38-28-33-48(5)39(38)29-34-50(7)43(48)26-27-44-49(6)32-22-31-47(3,4)42(49)30-35-51(44,50)8/h15-16,37-44,46,53-54,56H,9-14,17-36H2,1-8H3,(H,52,55)/b16-15-

copy

InChIKey: CPMWMWUACIMRDK-NXVVXOECSA-N

copy

Reference

CAS: 223103-37-5

Properties Information

Molecule Weight: 782.2919999999995

TPSA: 89.79

MolLogP: 12.350399999999988

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information