Boldine
Properties
- Molecular formula
- C19H21NO4
- Molar mass
- 327.38 g/mol
- Exact mass
- 327.1471 Da
- Melting point
- 163 °C
- logP
- 2.87Crippen estimate
- Polar surface area
- 62.2 Ų
- H-bond donors / acceptors
- 2 / 5
- Rotatable bonds
- 2
- Stereocentres
- Sin SMILES atom order
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
Aggregated from 42 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264, P270, P301+P317, P330, P501
Identifiers
CAS number
476-70-0SMILES
COc1cc2c(cc1O)C[C@H]1c3c(cc(O)c(OC)c3-2)CCN1CInChIKey
LZJRNLRASBVRRX-ZDUSSCGKSA-NInChI
InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3/t13-/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
15 names · show all
- 4H-Dibenzo[de,g]quinoline-2,9-diol, 5,6,6a,7-tetrahydro-1,10-dimethoxy-6-methyl-, (6aS)-
- 6Aα-Aporphine-2,9-diol, 1,10-dimethoxy-
- 4H-Dibenzo[de,g]quinoline-2,9-diol, 5,6,6a,7-tetrahydro-1,10-dimethoxy-6-methyl-, (S)-
- (6aS)-5,6,6a,7-Tetrahydro-1,10-dimethoxy-6-methyl-4H-dibenzo[de,g]quinoline-2,9-diol
- (S)-Boldine
- 1,10-Dimethoxy-6aα-aporphine-2,9-diol
- (+)-(S)-Boldine
- Boldin
- Boldina
- (+)-Boldine
- (+)-2,9-Dihydroxy-1,10-dimethoxyaporphine
- (S)-(+)-Boldine
- d-Boldine
- NSC 65689
- (6AS)-1,10-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,9-diol
Work with Boldine
Similar compounds
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Dicentrine517-66-865 % similar
Nuciferine475-83-261 % similar
(+)-Laurolitsine5890-18-661 % similar
(+)-Isocorydine475-67-258 % similar
Isocorydine hydrochloride13552-72-255 % similar
Cycleanine518-94-548 % similar
(+)-Norisoboldine23599-69-147 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds