Heliovicine

PubChem CID: 155153

Connections displayed (default: 10).

Loading graph...

ℹ️ Click here to know more about the properties

Compound Synonyms	Heliovicine, 68473-85-8, Butanoic acid, 2,3-dihydroxy-2-(1-methylethyl)-, ((1R,7aS)-hexahydro-1H-pyrrolizin-1-yl)methyl ester, (2R,3S)-, O1FR34Y6JP, UNII-O1FR34Y6JP, [(1R,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2R)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoate, ((1R,8S)-2,3,5,6,7,8-HEXAHYDRO-1H-PYRROLIZIN-1-YL)METHYL (2R)-2-HYDROXY-2-((1S)-1-HYDROXYETHYL)-3-METHYL-BUTANOATE, [(1R,7aS)-hexahydro-1H-pyrrolizin-1-yl]methyl (2R)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoate, ((1R,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)methyl (2R)-2-hydroxy-2-((1S)-1-hydroxyethyl)-3-methylbutanoate, AKOS040734527, (2R,3S)-2,3-Dihydroxy-2-isopropylbutanoic acid [(1R,7aS)-hexahydro-1H-pyrrolizin-1-yl]methyl ester
Ghose Rule	True
Classyfire Kingdom	Organic compounds
Topological Polar Surface Area	70.0
Hydrogen Bond Donor Count	2.0
Pfizer 3 75 Rule	False
Scaffold Graph Level	C1CC2CCCC2C1
Np Classifier Class	Pyrrolizidine alkaloids
Deep Smiles	CC[C@]C=O)OC[C@@H]CCN[C@H]5CCC5)))))))))))[C@@H]O)C))O))C
Heavy Atom Count	20.0
Classyfire Class	Pyrrolizidines
Scaffold Graph Node Level	C1CC2CCCN2C1
Isotope Atom Count	0.0
Molecular Complexity	360.0
Database Name	cmaup_ingredients;imppat_phytochem;npass_chem_all;pubchem
Defined Atom Stereocenter Count	4.0
Iupac Name	[(1R,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2R)-2-hydroxy-2-[(1S)-1-hydroxyethyl]-3-methylbutanoate
Prediction Hob	1.0
Veber Rule	True
Classyfire Superclass	Organoheterocyclic compounds
Xlogp	1.4
Gsk 4 400 Rule	True
Molecular Formula	C15H27NO4
Scaffold Graph Node Bond Level	C1CC2CCCN2C1
Prediction Swissadme	1.0
Inchi Key	BWQSLRZZOVFVHJ-PWNZVWSESA-N
Silicos It Class	Soluble
Fcsp3	0.9333333333333332
Logs	-2.03
Rotatable Bond Count	6.0
Logd	1.504
Synonyms	heliovicine
Esol Class	Soluble
Functional Groups	CN(C)C, CO, COC(C)=O
Compound Name	Heliovicine
Prediction Hob Swissadme	1.0
Exact Mass	285.194
Formal Charge	0.0
Monoisotopic Mass	285.194
Hydrogen Bond Acceptor Count	5.0
Molecular Weight	285.38
Gi Absorption	True
Covalent Unit Count	1.0
Total Atom Stereocenter Count	4.0
Total Bond Stereocenter Count	0.0
Lipinski Rule Of 5	True
Esol	-2.082780799999999
Inchi	InChI=1S/C15H27NO4/c1-10(2)15(19,11(3)17)14(18)20-9-12-6-8-16-7-4-5-13(12)16/h10-13,17,19H,4-9H2,1-3H3/t11-,12-,13-,15+/m0/s1
Smiles	C[C@@H]([C@](C(C)C)(C(=O)OC[C@@H]1CCN2[C@H]1CCC2)O)O
Nring	2.0
Np Classifier Biosynthetic Pathway	Alkaloids
Defined Bond Stereocenter Count	0.0
Egan Rule	True
Np Classifier Superclass	Ornithine alkaloids

1. Outgoing r'ship FOUND_IN to/from Albizia Amara (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Centaurea Amara (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Heliotropium Amplexicaule (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Heliotropium Angiospermum (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Heliotropium Arborescens (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Heliotropium Arguzioides (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Heliotropium Bacciferum (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Heliotropium Bovei (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Heliotropium Crispum (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Heliotropium Curassavicum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all; Reference:
11. Outgoing r'ship FOUND_IN to/from Heliotropium Digynum (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Heliotropium Eichwaldii (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Heliotropium Ellipticum (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Heliotropium Europaeum (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Heliotropium Floridum (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Heliotropium Glutinosum (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Heliotropium Hirsutissimum (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Heliotropium Hirsutum (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Heliotropium Indicum (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Heliotropium Keralense (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Heliotropium Lasiocarpum (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Heliotropium Marifolium (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Heliotropium Olgae (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Heliotropium Ovalifolium (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Heliotropium Ramosissimum (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Heliotropium Rotundifolium (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Heliotropium Scabrum (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Heliotropium Steudneri (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Heliotropium Strigosum (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Heliotropium Subulatum (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Heliotropium Supinum (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Heliotropium Tuberculosum (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Heliotropium Zeylanicum (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Iberis Amara (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Ilex Amara (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Indigofera Arrecta (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Indigofera Aspalathoides (Plant) Rel Props:Source_db:npass_chem_all
38. Outgoing r'ship FOUND_IN to/from Indigofera Astragalina (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Indigofera Caerulea (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Indigofera Cassioides (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Indigofera Cordifolia (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Indigofera Ennaephylla (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Indigofera Galegoides (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Indigofera Glabra (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Indigofera Hebepetala (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Indigofera Heterantha (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Indigofera Hirsuta (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Indigofera Hochstetteri (Plant) Rel Props:Reference:
49. Outgoing r'ship FOUND_IN to/from Indigofera Ioides (Plant) Rel Props:Reference:
50. Outgoing r'ship FOUND_IN to/from Indigofera Linifolia (Plant) Rel Props:Reference:
51. Outgoing r'ship FOUND_IN to/from Indigofera Linnaei (Plant) Rel Props:Reference:
52. Outgoing r'ship FOUND_IN to/from Indigofera Longiracemosa (Plant) Rel Props:Reference:
53. Outgoing r'ship FOUND_IN to/from Indigofera Mysorensis (Plant) Rel Props:Reference:
54. Outgoing r'ship FOUND_IN to/from Indigofera Nummulariifolia (Plant) Rel Props:Reference:
55. Outgoing r'ship FOUND_IN to/from Indigofera Oblongifolia (Plant) Rel Props:Reference:
56. Outgoing r'ship FOUND_IN to/from Indigofera Spicata (Plant) Rel Props:Reference:
57. Outgoing r'ship FOUND_IN to/from Indigofera Suffruticosa (Plant) Rel Props:Reference:
58. Outgoing r'ship FOUND_IN to/from Indigofera Tinctoria (Plant) Rel Props:Reference:
59. Outgoing r'ship FOUND_IN to/from Indigofera Uniflora (Plant) Rel Props:Reference:
60. Outgoing r'ship FOUND_IN to/from Indigofera Wightii (Plant) Rel Props:Reference:
61. Outgoing r'ship FOUND_IN to/from Luffa Amara (Plant) Rel Props:Reference:
62. Outgoing r'ship FOUND_IN to/from Mimosa Amara (Plant) Rel Props:Reference:
63. Outgoing r'ship FOUND_IN to/from Polygala Amara (Plant) Rel Props:Reference:
64. Outgoing r'ship FOUND_IN to/from Quassia Amara (Plant) Rel Props:Reference:
65. Outgoing r'ship FOUND_IN to/from Saussurea Amara (Plant) Rel Props:Reference:
66. Outgoing r'ship FOUND_IN to/from Simarouba Amara (Plant) Rel Props:Source_db:npass_chem_all
67. Outgoing r'ship FOUND_IN to/from Simarouba Glauca (Plant) Rel Props:Reference:

Back to Browse Back to Home

GRAYU Website

Grayu

Heliovicine

Graph

Phytochemical Properties

Associated Connections 67

Plant Connections 67