Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA031396
PROPERTIES
| NPAID | NPA031396 |
|---|---|
| CLUSTER ID | 178 |
| NODE ID | 166 |
| NAME | 35-O-β-D-Galacturonopyranosyl-2-methyl-32,33,34,35-bacteriohopanetetrol |
| FORMULA | C42H72O10 |
| MOLECULAR WEIGHT (Da) | 737.0280 |
| ACCURATE MASS (Da) | 736.5125 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Synechococcus |
| ORIGIN SPECIES | pCC 6907 |
| InChIKey | JUVWOMZTBBMJEZ-GCZDOJFISA-N |
| InChI | InChI=1S/C42H72O10/c1-22-19-38(3,4)28-15-18-42(8)30(40(28,6)20-22)12-11-29-39(5)16-13-24(25(39)14-17-41(29,42)7)23(2)9-10-26(43)31(45)27(44)21-51-37-34(48)32(46)33(47)35(52-37)36(49)50/h22-35,37,43-48H,9-21H2,1-8H3,(H,49,50)/t22-,23+,24-,25?,26-,27+,28?,29?,30?,31-,32+,33-,34-,35+,37-,39+,40+,41-,42-/m1/s1 |
| SMILES | C[C@@H](CC[C@@H](O)[C@@H](O)[C@@H](O)CO[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)[C@H]1CC[C@@]2(C)C1CC[C@]1(C)C2CCC2[C@@]3(C)C[C@H](C)CC(C)(C)C3CC[C@]21C |
ORIGINAL ISOLATION REFERENCE
| CITATION | Pascale Simonin, Uwe J. Jürgens, Michel Rohmer Bacterial triterpenoids of the hopane series from the prochlorophyte Prochlorothrix hollandica and their intracellular localization. European Journal of Biochemistry 1996 241 (3) 865-871. | ||
|---|---|---|---|
| DOI | 10.1111/j.1432-1033.1996.00865.x | PMID | 8944776 |
