8,9-Dihydroxy-1,5,6,10B-tetrahydropyrrolo[2,1-A]isoquinolin-3(2H)-one

PubChem CID: 21574476

Connections displayed (default: 10).

Loading graph...

ℹ️ Click here to know more about the properties

Compound Synonyms	Oleracein E, 1021950-79-7, 8,9-DIHYDROXY-1,5,6,10B-TETRAHYDROPYRROLO[2,1-A]ISOQUINOLIN-3(2H)-ONE, (+/-)-Trolline, 8,9-dihydroxy-2,5,6,10b-tetrahydro-1H-pyrrolo[2,1-a]isoquinolin-3-one, ( inverted exclamation markA)-Trolline, Trolline, ()-Trolline, CHEMBL2160181, LJIDRFNRDLYHNC-UHFFFAOYSA-, DTXSID30904168, WQB95079, AKOS027330746, FS-8508, DA-66330, HY-113806, CS-0062907, 8,9-dihydroxy-1H,2H,5H,6H,10bH-pyrrolo[2,1-a]isoquinolin-3-one, InChI=1/C12H13NO3/c14-10-5-7-3-4-13-9(1-2-12(13)16)8(7)6-11(10)15/h5-6,9,14-15H,1-4H2
Topological Polar Surface Area	60.8
Hydrogen Bond Donor Count	2.0
Heavy Atom Count	16.0
Isotope Atom Count	0.0
Molecular Complexity	307.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	8,9-dihydroxy-2,5,6,10b-tetrahydro-1H-pyrrolo[2,1-a]isoquinolin-3-one
Prediction Hob	1.0
Xlogp	0.6
Molecular Formula	C12H13NO3
Prediction Swissadme	0.0
Inchi Key	LJIDRFNRDLYHNC-UHFFFAOYSA-N
Fcsp3	0.4166666666666667
Logs	-2.076
Rotatable Bond Count	0.0
Logd	0.892
Compound Name	8,9-Dihydroxy-1,5,6,10B-tetrahydropyrrolo[2,1-A]isoquinolin-3(2H)-one
Prediction Hob Swissadme	0.0
Exact Mass	219.09
Formal Charge	0.0
Monoisotopic Mass	219.09
Hydrogen Bond Acceptor Count	3.0
Molecular Weight	219.24
Covalent Unit Count	1.0
Total Atom Stereocenter Count	1.0
Total Bond Stereocenter Count	0.0
Esol	-1.879988
Inchi	InChI=1S/C12H13NO3/c14-10-5-7-3-4-13-9(1-2-12(13)16)8(7)6-11(10)15/h5-6,9,14-15H,1-4H2
Smiles	C1CC(=O)N2C1C3=CC(=C(C=C3CC2)O)O
Nring	3.0
Defined Bond Stereocenter Count	0.0

1. Outgoing r'ship FOUND_IN to/from Acmella Oleracea (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Andrographis Herba (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Brassica Oleracea (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Cirsium Arvense (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Cirsium Brevistylum (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Cirsium Canum (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Cirsium Carolinianum (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Cirsium Chinense (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Cirsium Dipsacolepis (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Cirsium Helenioides (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Cirsium Japonicum (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Cirsium Lineare (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Cirsium Oligophyllum (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Cirsium Setosum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
15. Outgoing r'ship FOUND_IN to/from Cirsium Tanakae (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Cirsium Verutum (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Cirsium Wallichii (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Corydalis Bungeanae (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Cyphostemma Setosum (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Ephedra Herba (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Hedyotis Diffusae (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Neptunia Oleracea (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Portulaca Grandiflora (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Portulaca Guadrifida (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Portulaca Obracea (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Portulaca Oleracea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
27. Outgoing r'ship FOUND_IN to/from Portulaca Pilosa (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Portulaca Quadrifida (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Portulaca Tuberosa (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Spilanthes Oleracea (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Spinacia Oleracea (Plant) Rel Props:Reference:

Back to Browse Back to Home

GRAYU Website

Grayu

8,9-Dihydroxy-1,5,6,10B-tetrahydropyrrolo[2,1-A]isoquinolin-3(2H)-one

Graph

Phytochemical Properties

Associated Connections 31

Plant Connections 31