(+)-Isocorydine

C20H23NO4CAS 475-67-2341.41 g/mol

Open in Covalent MOL file
OOHOON
EtherPhenolTertiary amine

Properties

Molecular formula
C20H23NO4
Molar mass
341.41 g/mol
Exact mass
341.1627 Da
Melting point
185 °C
logP
3.17Crippen estimate
Polar surface area
51.2 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
3
Stereocentres
Sin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
475-67-2
SMILES
COc1ccc2c(c1O)-c1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3
InChIKey
QELDJEKNFOQJOY-ZDUSSCGKSA-N
InChI
InChI=1S/C20H23NO4/c1-21-8-7-12-10-15(24-3)20(25-4)18-16(12)13(21)9-11-5-6-14(23-2)19(22)17(11)18/h5-6,10,13,22H,7-9H2,1-4H3/t13-/m0/s1

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Names and synonyms

13 names · show all
  • 4H-Dibenzo[de,g]quinolin-11-ol, 5,6,6a,7-tetrahydro-1,2,10-trimethoxy-6-methyl-, (6aS)-
  • Isocorydine
  • 6Aα-Aporphin-11-ol, 1,2,10-trimethoxy-
  • 4H-Dibenzo[de,g]quinolin-11-ol, 5,6,6a,7-tetrahydro-1,2,10-trimethoxy-6-methyl-, (S)-
  • (6aS)-5,6,6a,7-Tetrahydro-1,2,10-trimethoxy-6-methyl-4H-dibenzo[de,g]quinolin-11-ol
  • Luteanine
  • d-Isocorydine
  • L-(+)-Isocorydine
  • (+)-(S)-Isocorydine
  • Luteanin
  • Luteanine (aporphine)
  • (S)-(+)-Isocorydine
  • NSC 32979

Work with (+)-Isocorydine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Isocorydine hydrochloride13552-72-2Salt

Similar compounds

(+)-Glaucine475-81-066 % similar Nuciferine475-83-265 % similar Boldine476-70-058 % similar Cycleanine518-94-554 % similar Dicentrine517-66-853 % similar Magnoflorine2141-09-550 % similar Fangchinoline436-77-149 % similar 1-Isotetrandrine477-57-647 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Boc-D-4,4'-biphenylalanine128779-47-5 Efaproxiral131179-95-8 Boc-L-3,3-diphenylalanine138662-63-2 Boc-L-4,4'-biphenylalanine147923-08-8 Naltrexone16590-41-3 1-[(3,4-Dimethoxyphenyl)methyl]-3,4-dihydro-6,7-dimethoxyisoquinoline6957-27-3

Elsewhere

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