Molecule

32,33,34,35-Bacteriohopanetetrol; (21βH,32R,33R,34S)-form, 35-O-(6-Amino-6-deoxy-β-D-glucopyranoside)

AlkaPlorer ID: AK290102

Synonym: None

IUPAC Name: 2-[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)-2,3,4-trihydroxyoctoxy]-6-(aminomethyl)oxane-3,4,5-triol

Structure

SMILES: CC(CCC(O)C(O)C(O)COC1OC(CN)C(O)C(O)C1O)C1CCC2(C)C1CCC1(C)C2CCC2C3(C)CCCC(C)(C)C3CCC21C

InChI: InChI=1S/C41H73NO8/c1-23(9-10-26(43)32(45)27(44)22-49-36-35(48)34(47)33(46)28(21-42)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: HEUSSFSVKKVAFQ-UHFFFAOYSA-N

Reference

35-O-β-Amino-deoxyglucopyranosyl bacteriohopanetetrol, a novel triterpenoid of the hopane series from the cyanobacterium synechocystis sp. PCC 6714

PubChem CID: 74052721

LOTUS: LTS0230656

COCONUT: CNP0292107.3

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Synechocystis sp.	Synechocystis	Merismopediaceae	Synechococcales	Cyanophyceae	Cyanobacteriota	None	Bacteria

Properties Information

Molecule Weight: 708.0339999999997

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