CAS Registry Number®
2292-16-2
CAS Name
(-)-Neferine
Molecular Formula
C38H44N2O6
Molecular Mass
624.77
Compound Properties
-
Melting Point (1)
59-61 °C
Source(s)
- (1) Yang, Jian; Magnetic Resonance in Chemistry, (2004), 42(11), 994-997, CAplus
Other Names and Identifiers
InChI
InChI=1S/C38H44N2O6/c1-39-15-14-27-21-36(44-5)38(23-30(27)31(39)17-24-7-10-28(42-3)11-8-24)46-34-19-25(9-12-33(34)41)18-32-29-22-37(45-6)35(43-4)20-26(29)13-16-40(32)2/h7-12,19-23,31-32,41H,13-18H2,1-6H3/t31-,32+/m1/s1
InChIKey
InChIKey=MIBATSHDJRIUJK-ZWXJPIIXSA-N
SMILES
C([C@@H]1C=2C(=CC(OC)=C(OC3=CC(C[C@H]4C=5C(=CC(OC)=C(OC)C5)CCN4C)=CC=C3O)C2)CCN1C)C6=CC=C(OC)C=C6
Canonical SMILES
OC1=CC=C(C=C1OC=2C=C3C(=CC2OC)CCN(C)C3CC4=CC=C(OC)C=C4)CC5C6=CC(OC)=C(OC)C=C6CCN5C
Other Names for this Substance
- Phenol, 4-[[(1S)-1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl]methyl]-2-[[(1R)-1,2,3,4-tetrahydro-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-7-isoquinolinyl]oxy]-
- Neferine
- 4-[[(1S)-1,2,3,4-Tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl]methyl]-2-[[(1R)-1,2,3,4-tetrahydro-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-7-isoquinolinyl]oxy]phenol
- Neferin
- 4′′-O-Methylliensinine
- Methylliensinine
- (-)-Neferine
- SC 185
