5'-Hydroxythalifaboramine
AlkaPlorer ID: AK007836
Synonym: "(+)-5'-Hydroxythalifaboramine"
IUPAC Name: (6aS)-8-[4-[[(1S)-5-hydroxy-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-ol
Structure
SMILES: COC1=CC2=C(C[C@H]3C4=C(C=C(OC)C(OC)=C24)CCN3C)C(OC2=CC=C(C[C@H]3C4=CC(OC)=C(OC)C(O)=C4CCN3C)C=C2)=C1O
InChI: InChI=1S/C39H44N2O8/c1-40-15-13-24-25(19-32(46-5)39(48-7)35(24)42)28(40)16-21-8-10-23(11-9-21)49-37-27-18-29-33-22(12-14-41(29)2)17-31(45-4)38(47-6)34(33)26(27)20-30(44-3)36(37)43/h8-11,17,19-20,28-29,42-43H,12-16,18H2,1-7H3/t28-,29-/m0/s1
InChIKey: OCQIGPWTTUGDSS-VMPREFPWSA-N
Reference
Phenolic aporphine-benzylisoquinoline alkaloids from Thalictrum faberi
PubChem CID: 10699628
LOTUS: LTS0184369
SuperNatural Ⅲ: SN0261794-01
Source
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Properties Information
Molecule Weight: 668.7870000000001
TPSA？: 102.32
MolLogP？: 6.456900000000009
Number of H-Donors: 2
Number of H-Acceptors: 10
RingCount: 7
Activities Information
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