Corynoline
PubChem CID: 177014
Connections displayed (default: 10).
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| Compound Synonyms | Corynoline, 18797-79-0, (+)-corynoline, 13-methylchelidonine, Chelidonine, 13-methyl-, [1,3]Benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridin-6-ol, 5b,6,7,12b,13,14-hexahydro-5b,13-dimethyl-, (5bR,6S,12bR)-, ZQ9W3JU6N3, (11S,13R,14R)-corynoline, (1R,12S,13R)-13,24-dimethyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol, CHEMBL4126384, CHEBI:65660, DTXSID20940272, 68035-45-0, (5bR,6S,12bR)-5b,13-dimethyl-5b,6,7,12b,13,14-hexahydro[1,3]benzodioxolo[5,6-c][1,3]dioxolo[4,5-i]phenanthridin-6-ol, 13,24-Dimethyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol, (5BR,6S,12BR)-5B,6,7,12B,13,14-HEXAHYDRO-5B,13-DIMETHYL(1,3)BENZODIOXOLO(5,6-C)-1,3-DIOXOLO(4,5-I)PHENANTHRIDIN-6-OL, (1R,12S,13R)-13,24-dimethyl-5,7,18,20-tetraoxa-24-azahexacyclo(11.11.0.02,10.04,8.014,22.017,21)tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol, (5BR,6S,12BR)-5b,13-Dimethyl-5b,6,7,12b,13,14-hexahydro(1,3)benzodioxolo(5,6-c)(1,3)dioxolo(4,5-i)phenanthridin-6-ol, Corynoline (Standard), UNII-ZQ9W3JU6N3, SCHEMBL3127828, Corynoline, >=98% (HPLC), HY-N0826R, DTXCID701368743, HY-N0826, (invertedexclamationmarkA)-Corynoline, BDBM50276146, s9085, AKOS015896713, CCG-268252, FC73889, ( inverted exclamation markA)-Corynoline, AC-35078, AS-75490, CS-0009858, Q15410919 |
|---|---|
| Topological Polar Surface Area | 60.4 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 27.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 603.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 3.0 |
| Uniprot Id | P27338, P21397 |
| Iupac Name | (1R,12S,13R)-13,24-dimethyl-5,7,18,20-tetraoxa-24-azahexacyclo[11.11.0.02,10.04,8.014,22.017,21]tetracosa-2,4(8),9,14(22),15,17(21)-hexaen-12-ol |
| Prediction Hob | 1.0 |
| Xlogp | 2.7 |
| Molecular Formula | C21H21NO5 |
| Prediction Swissadme | 0.0 |
| Inchi Key | IQUGPRHKZNCHGC-TYPHKJRUSA-N |
| Fcsp3 | 0.4285714285714285 |
| Logs | -4.054 |
| Rotatable Bond Count | 0.0 |
| Logd | 2.608 |
| Compound Name | Corynoline |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 367.142 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 367.142 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 367.4 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 3.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.147775088888889 |
| Inchi | InChI=1S/C21H21NO5/c1-21-14-3-4-15-19(27-10-24-15)13(14)8-22(2)20(21)12-7-17-16(25-9-26-17)5-11(12)6-18(21)23/h3-5,7,18,20,23H,6,8-10H2,1-2H3/t18-,20+,21-/m0/s1 |
| Smiles | C[C@]12[C@H](CC3=CC4=C(C=C3[C@H]1N(CC5=C2C=CC6=C5OCO6)C)OCO4)O |
| Nring | 6.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Artocarpus Incisa (Plant) Rel Props:Reference: - 2. Outgoing r'ship
FOUND_INto/from Corydalis Adunca (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Corydalis Ambigua (Plant) Rel Props:Reference: - 4. Outgoing r'ship
FOUND_INto/from Corydalis Aurea (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Corydalis Bungeanae (Plant) Rel Props:Reference: - 6. Outgoing r'ship
FOUND_INto/from Corydalis Calliantha (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Corydalis Cashmeriana (Plant) Rel Props:Reference: - 8. Outgoing r'ship
FOUND_INto/from Corydalis Caucasica (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Corydalis Cava (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Corydalis Chaerophylla (Plant) Rel Props:Reference: - 11. Outgoing r'ship
FOUND_INto/from Corydalis Cheilanthifolia (Plant) Rel Props:Reference: - 12. Outgoing r'ship
FOUND_INto/from Corydalis Claviculata (Plant) Rel Props:Reference: - 13. Outgoing r'ship
FOUND_INto/from Corydalis Conspersa (Plant) Rel Props:Reference: - 14. Outgoing r'ship
FOUND_INto/from Corydalis Cornuta (Plant) Rel Props:Reference: - 15. Outgoing r'ship
FOUND_INto/from Corydalis Crystallina (Plant) Rel Props:Reference: - 16. Outgoing r'ship
FOUND_INto/from Corydalis Decumbens (Plant) Rel Props:Reference: - 17. Outgoing r'ship
FOUND_INto/from Corydalis Densiflora (Plant) Rel Props:Reference: - 18. Outgoing r'ship
FOUND_INto/from Corydalis Flabellata (Plant) Rel Props:Reference: - 19. Outgoing r'ship
FOUND_INto/from Corydalis Gigantea (Plant) Rel Props:Reference: - 20. Outgoing r'ship
FOUND_INto/from Corydalis Govaniana (Plant) Rel Props:Reference: - 21. Outgoing r'ship
FOUND_INto/from Corydalis Incisa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 22. Outgoing r'ship
FOUND_INto/from Corydalis Ledebouriana (Plant) Rel Props:Reference: - 23. Outgoing r'ship
FOUND_INto/from Corydalis Linearioides (Plant) Rel Props:Reference: - 24. Outgoing r'ship
FOUND_INto/from Corydalis Longicalcarata (Plant) Rel Props:Reference: - 25. Outgoing r'ship
FOUND_INto/from Corydalis Longipes (Plant) Rel Props:Reference: - 26. Outgoing r'ship
FOUND_INto/from Corydalis Marschalliana (Plant) Rel Props:Reference: - 27. Outgoing r'ship
FOUND_INto/from Corydalis Meifolia (Plant) Rel Props:Reference: - 28. Outgoing r'ship
FOUND_INto/from Corydalis Montana (Plant) Rel Props:Reference: - 29. Outgoing r'ship
FOUND_INto/from Corydalis Mucronifera (Plant) Rel Props:Reference: - 30. Outgoing r'ship
FOUND_INto/from Corydalis Ochotensis (Plant) Rel Props:Reference: - 31. Outgoing r'ship
FOUND_INto/from Corydalis Ophiocarpa (Plant) Rel Props:Reference: - 32. Outgoing r'ship
FOUND_INto/from Corydalis Pallida (Plant) Rel Props:Reference: - 33. Outgoing r'ship
FOUND_INto/from Corydalis Persica (Plant) Rel Props:Reference: - 34. Outgoing r'ship
FOUND_INto/from Corydalis Racemosa (Plant) Rel Props:Reference: - 35. Outgoing r'ship
FOUND_INto/from Corydalis Ramose (Plant) Rel Props:Reference: - 36. Outgoing r'ship
FOUND_INto/from Corydalis Remota (Plant) Rel Props:Reference: - 37. Outgoing r'ship
FOUND_INto/from Corydalis Repens (Plant) Rel Props:Reference: - 38. Outgoing r'ship
FOUND_INto/from Corydalis Rhizoma (Plant) Rel Props:Reference: - 39. Outgoing r'ship
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FOUND_INto/from Corydalis Solida (Plant) Rel Props:Reference: - 45. Outgoing r'ship
FOUND_INto/from Corydalis Stricta (Plant) Rel Props:Reference: - 46. Outgoing r'ship
FOUND_INto/from Corydalis Suaveolens (Plant) Rel Props:Reference: - 47. Outgoing r'ship
FOUND_INto/from Corydalis Taliensis (Plant) Rel Props:Reference: - 48. Outgoing r'ship
FOUND_INto/from Corydalis Tashiroi (Plant) Rel Props:Reference: - 49. Outgoing r'ship
FOUND_INto/from Corydalis Ternata (Plant) Rel Props:Reference: - 50. Outgoing r'ship
FOUND_INto/from Corydalis Thalictrifolia (Plant) Rel Props:Reference: - 51. Outgoing r'ship
FOUND_INto/from Corydalis Thyrsiflora (Plant) Rel Props:Reference: - 52. Outgoing r'ship
FOUND_INto/from Corydalis Tibetica (Plant) Rel Props:Reference: - 53. Outgoing r'ship
FOUND_INto/from Corydalis Tuberosa (Plant) Rel Props:Reference: - 54. Outgoing r'ship
FOUND_INto/from Corydalis Turtschaninovii (Plant) Rel Props:Reference: - 55. Outgoing r'ship
FOUND_INto/from Corydalis Vaginans (Plant) Rel Props:Reference: - 56. Outgoing r'ship
FOUND_INto/from Corydalis Yanhusuo (Plant) Rel Props:Reference: - 57. Outgoing r'ship
FOUND_INto/from Fraxinus Bungeana (Plant) Rel Props:Reference: - 58. Outgoing r'ship
FOUND_INto/from Pinus Bungeana (Plant) Rel Props:Reference: - 59. Outgoing r'ship
FOUND_INto/from Trigonella Incisa (Plant) Rel Props:Reference: