| Identification | Back Directory | [Name]
(-)-8-[(S)-2,3-Dihydroxy-3-methylbutyl]-7-methoxy-2H-1-benzopyran-2-one | [CAS]
5875-49-0 | [Synonyms]
Merancin hyrate
Merancin hydrate
Meranzin hydrate
(-)-Merancin hydrate
(-)-Meranzin hydrate
2H-1-Benzopyran-2-one, 8-[(2S)-2,3-dihydroxy-3-methylbutyl]-7-methoxy-
(-)-8-[(S)-2,3-Dihydroxy-3-methylbutyl]-7-methoxy-2H-1-benzopyran-2-one | [Molecular Formula]
C15H18O5 | [MDL Number]
MFCD18974714 | [MOL File]
5875-49-0.mol | [Molecular Weight]
278.3 |
| Chemical Properties | Back Directory | [Melting point ]
130-131 °C(Solv: ethyl ether (60-29-7)) | [Boiling point ]
500.5±50.0 °C(Predicted) | [density ]
1.271±0.06 g/cm3(Predicted) | [storage temp. ]
-20°C | [solubility ]
Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc. | [form ]
Powder | [pka]
14.46±0.20(Predicted) | [color ]
White to off-white | [Optical Rotation]
[α]/D -32.0 to -26.0°, c =0.11 in chloroform | [InChI]
InChI=1S/C15H18O5/c1-15(2,18)12(16)8-10-11(19-3)6-4-9-5-7-13(17)20-14(9)10/h4-7,12,16,18H,8H2,1-3H3/t12-/m0/s1 | [InChIKey]
KGGUASRIGLRPAX-LBPRGKRZSA-N | [SMILES]
C1(=O)OC2=C(C[C@H](O)C(O)(C)C)C(OC)=CC=C2C=C1 | [LogP]
0.610 (est) |
| Hazard Information | Back Directory | [Uses]
metabolomics
vitamins, nutraceuticals, and natural products | [target]
Adrenergic Receptor | ERK | [storage]
Store at 2-8°C, protect from light |
|
|