(20R)-Ginsenoside Rh2
PubChem CID: 14081290
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| Compound Synonyms | (20R)-Ginsenoside Rh2, Ginsenoside Rh2 (S-FORM), 112246-15-8, 2-[[12-hydroxy-17-(2-hydroxy-6-methylhept-5-en-2-yl)-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol, 67400-17-3, MFCD22200425, (3beta,12beta)-12,20-dihydroxydammar-24-en-3-yl beta-D-glucopyranoside, (S)-(3b,12b)-12,20-Dihydroxydammar-24-en-3-yl beta-D-glucopyranoside, CHEBI:172776, BCP10285, BCP23574, SCA40017, LS-15384, SY105541, 20(S)-Ginsenoside Rh2, 20(S)-Rh2, Ginsenoside-Rh2, 3-O-(c)micro-D-Glucopyranoside pound>>(R)Ginsenoside-Rh2 pound>>20(R)-Ginsenoside, 2-{[11-hydroxy-1-(2-hydroxy-6-methylhept-5-en-2-yl)-3a,3b,6,6,9a-pentamethyl-dodecahydro-1H-cyclopenta[a]phenanthren-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol |
|---|---|
| Topological Polar Surface Area | 140.0 |
| Hydrogen Bond Donor Count | 6.0 |
| Heavy Atom Count | 44.0 |
| Description | Isolated from Panax ginseng (ginseng). Ginsenoside Rh2 is found in tea. |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 1070.0 |
| Database Name | cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-[[12-hydroxy-17-(2-hydroxy-6-methylhept-5-en-2-yl)-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol |
| Prediction Hob | 0.0 |
| Class | Prenol lipids |
| Xlogp | 5.6 |
| Superclass | Lipids and lipid-like molecules |
| Subclass | Triterpenoids |
| Molecular Formula | C36H62O8 |
| Prediction Swissadme | 0.0 |
| Inchi Key | CKUVNOCSBYYHIS-UHFFFAOYSA-N |
| Fcsp3 | 0.9444444444444444 |
| Logs | -3.563 |
| Rotatable Bond Count | 7.0 |
| Logd | 4.173 |
| Synonyms | Ginsenoside Rh2, Ginsenoside RH2 |
| Compound Name | (20R)-Ginsenoside Rh2 |
| Kingdom | Organic compounds |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 622.444 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 622.444 |
| Hydrogen Bond Acceptor Count | 8.0 |
| Molecular Weight | 622.9 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 15.0 |
| Total Bond Stereocenter Count | 0.0 |
| Molecular Framework | Aliphatic heteropolycyclic compounds |
| Esol | -6.767880800000003 |
| Inchi | InChI=1S/C36H62O8/c1-20(2)10-9-14-36(8,42)21-11-16-35(7)27(21)22(38)18-25-33(5)15-13-26(32(3,4)24(33)12-17-34(25,35)6)44-31-30(41)29(40)28(39)23(19-37)43-31/h10,21-31,37-42H,9,11-19H2,1-8H3 |
| Smiles | CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)O)C)C)O)C)O)C |
| Nring | 5.0 |
| Defined Bond Stereocenter Count | 0.0 |
| Taxonomy Direct Parent | Triterpenoids |
- 1. Outgoing r'ship
FOUND_INto/from Panax Ginseng (Plant) Rel Props:Source_db:cmaup_ingredients