Mevalonolactone
PubChem CID: 6419891
Connections displayed (default: 10).
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| Compound Synonyms | 19115-49-2, Mevalonolactone, (-)-Mevalonolactone, (R)-4-Hydroxy-4-methyltetrahydro-2H-pyran-2-one, (R)-(-)-Mevalonolactone, Adeka mevalonolactone, (R)-Mevalonolactone, 2H-Pyran-2-one, tetrahydro-4-hydroxy-4-methyl-, (4R)-, (3R)-Mevalonolactone, Mevalonolactone, (-)-, (-)-(R)-Mevalonic acid lactone, (-)-(R)-Mevalonolactone, 2H-Pyran-2-one, tetrahydro-4-hydroxy-4-methyl-, (R)-, Mevalonic acid lactone, Mevalonic-D, L acid lactone, CHEBI:67849, 661X270Z3L, (R)-(-)-3-Hydroxy-3-methyl-5-pentanolide, r-mevalonolactone, UNII-661X270Z3L, Prestwick_97, R(-)Mevalonolactone, (4R)-4-hydroxy-4-methyloxan-2-one, Prestwick0_000750, Prestwick1_000750, Prestwick2_000750, SCHEMBL879, R-mevalonolactone, (-)-, D,L-mevalonic-acid-lactone, SPBio_002679, CHEMBL1401520, HMS1570E22, AKOS017343730, SB47779, NCGC00016531-01, CAS-674-26-0, FB162521, (R)-(-)-Mevalonolactone, >=90.0% (GC), G85785, (4R)-4-Hydroxy-4-methyl-tetrahydropyran-2-one, (R)-beta-Hydroxy-beta-methyl-delta-valerolactone, Q27136326 |
|---|---|
| Topological Polar Surface Area | 46.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 9.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 132.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Uniprot Id | P02545, P11712, O94782 |
| Iupac Name | (4R)-4-hydroxy-4-methyloxan-2-one |
| Prediction Hob | 1.0 |
| Target Id | NPT483, NPT212 |
| Xlogp | -0.3 |
| Molecular Formula | C6H10O3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | JYVXNLLUYHCIIH-ZCFIWIBFSA-N |
| Fcsp3 | 0.8333333333333334 |
| Logs | -0.988 |
| Rotatable Bond Count | 0.0 |
| Logd | 0.409 |
| Compound Name | Mevalonolactone |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 130.063 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 130.063 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 130.139 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -0.4893866 |
| Inchi | InChI=1S/C6H10O3/c1-6(8)2-3-9-5(7)4-6/h8H,2-4H2,1H3/t6-/m1/s1 |
| Smiles | C[C@]1(CCOC(=O)C1)O |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
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FOUND_INto/from Saussurea Japonica (Plant) Rel Props:Reference: - 214. Outgoing r'ship
FOUND_INto/from Schefflera Heptaphylla (Plant) Rel Props:Reference: - 215. Outgoing r'ship
FOUND_INto/from Scopolia Japonica (Plant) Rel Props:Reference: - 216. Outgoing r'ship
FOUND_INto/from Senegalia Catechu (Plant) Rel Props:Reference: - 217. Outgoing r'ship
FOUND_INto/from Senegalia Mellifera (Plant) Rel Props:Reference: - 218. Outgoing r'ship
FOUND_INto/from Senegalia Pennata (Plant) Rel Props:Reference: - 219. Outgoing r'ship
FOUND_INto/from Senegalia Tenuifolia (Plant) Rel Props:Reference: - 220. Outgoing r'ship
FOUND_INto/from Setaria Glauca (Plant) Rel Props:Reference: - 221. Outgoing r'ship
FOUND_INto/from Simarouba Glauca (Plant) Rel Props:Reference: - 222. Outgoing r'ship
FOUND_INto/from Skimmia Japonica (Plant) Rel Props:Reference: - 223. Outgoing r'ship
FOUND_INto/from Sophora Glauca (Plant) Rel Props:Reference: - 224. Outgoing r'ship
FOUND_INto/from Sophora Japonica (Plant) Rel Props:Reference: - 225. Outgoing r'ship
FOUND_INto/from Spergula Japonica (Plant) Rel Props:Reference: - 226. Outgoing r'ship
FOUND_INto/from Spiraea Japonica (Plant) Rel Props:Reference: - 227. Outgoing r'ship
FOUND_INto/from Stemona Cochinchinensis (Plant) Rel Props:Reference: - 228. Outgoing r'ship
FOUND_INto/from Stemona Collinsae (Plant) Rel Props:Reference: - 229. Outgoing r'ship
FOUND_INto/from Stemona Japonica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 230. Outgoing r'ship
FOUND_INto/from Stemona Kerrii (Plant) Rel Props:Reference: - 231. Outgoing r'ship
FOUND_INto/from Stemona Parviflora (Plant) Rel Props:Reference: - 232. Outgoing r'ship
FOUND_INto/from Stemona Sessilifolia (Plant) Rel Props:Reference: - 233. Outgoing r'ship
FOUND_INto/from Stemona Tuberosa (Plant) Rel Props:Reference: - 234. Outgoing r'ship
FOUND_INto/from Stephania Japonica (Plant) Rel Props:Reference: - 235. Outgoing r'ship
FOUND_INto/from Swertia Japonica (Plant) Rel Props:Reference: - 236. Outgoing r'ship
FOUND_INto/from Tecoma Heptaphylla (Plant) Rel Props:Reference: - 237. Outgoing r'ship
FOUND_INto/from Ternstroemia Japonica (Plant) Rel Props:Reference: - 238. Outgoing r'ship
FOUND_INto/from Tetradenia Glauca (Plant) Rel Props:Reference: - 239. Outgoing r'ship
FOUND_INto/from Tilia Japonica (Plant) Rel Props:Reference: - 240. Outgoing r'ship
FOUND_INto/from Torilis Japonica (Plant) Rel Props:Reference: - 241. Outgoing r'ship
FOUND_INto/from Trapa Japonica (Plant) Rel Props:Reference: - 242. Outgoing r'ship
FOUND_INto/from Youngia Glauca (Plant) Rel Props:Reference: - 243. Outgoing r'ship
FOUND_INto/from Youngia Japonica (Plant) Rel Props:Reference: