(-)-Garcinialiptone A
PubChem CID: 46209649
Connections displayed (default: 10).
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| Compound Synonyms | (-)-Garcinialiptone A, CHEMBL1098251 |
|---|---|
| Topological Polar Surface Area | 109.0 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 44.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 1340.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 5.0 |
| Iupac Name | (1S,3R,5S,7R,8S)-1-(3,4-dihydroxybenzoyl)-6,6-dimethyl-5-(3-methylbut-2-enyl)-8-(2-methylprop-1-enyl)-3-(5-methyl-2-prop-1-en-2-ylhex-5-enyl)adamantane-2,4,9-trione |
| Prediction Hob | 0.0 |
| Xlogp | 9.5 |
| Molecular Formula | C38H48O6 |
| Prediction Swissadme | 0.0 |
| Inchi Key | DKHLFUGLTCKVOA-HXBTULIHSA-N |
| Fcsp3 | 0.5263157894736842 |
| Logs | -4.745 |
| Rotatable Bond Count | 11.0 |
| Logd | 5.409 |
| Compound Name | (-)-Garcinialiptone A |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 600.345 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 600.345 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 600.8 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 6.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -8.918544290909093 |
| Inchi | InChI=1S/C38H48O6/c1-21(2)11-12-26(24(7)8)19-36-20-28-27(17-23(5)6)38(33(36)43,31(41)25-13-14-29(39)30(40)18-25)34(44)37(32(36)42,35(28,9)10)16-15-22(3)4/h13-15,17-18,26-28,39-40H,1,7,11-12,16,19-20H2,2-6,8-10H3/t26?,27-,28+,36+,37-,38-/m0/s1 |
| Smiles | CC(=CC[C@@]12C(=O)[C@]3(C[C@@H](C1(C)C)[C@@H]([C@](C3=O)(C2=O)C(=O)C4=CC(=C(C=C4)O)O)C=C(C)C)CC(CCC(=C)C)C(=C)C)C |
| Nring | 5.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Garcinia Atroviridis (Plant) Rel Props:Reference: - 2. Outgoing r'ship
FOUND_INto/from Garcinia Cambogia (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Garcinia Cantleyana (Plant) Rel Props:Reference: - 4. Outgoing r'ship
FOUND_INto/from Garcinia Celebica (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Garcinia Conrauana (Plant) Rel Props:Reference: - 6. Outgoing r'ship
FOUND_INto/from Garcinia Cowa (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Garcinia Dulcis (Plant) Rel Props:Reference: - 8. Outgoing r'ship
FOUND_INto/from Garcinia Echinocarpa (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Garcinia Esculenta (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Garcinia Gaudichaudii (Plant) Rel Props:Reference: - 11. Outgoing r'ship
FOUND_INto/from Garcinia Griffithii (Plant) Rel Props:Reference: - 12. Outgoing r'ship
FOUND_INto/from Garcinia Hanburyi (Plant) Rel Props:Reference: - 13. Outgoing r'ship
FOUND_INto/from Garcinia Hombroniana (Plant) Rel Props:Reference: - 14. Outgoing r'ship
FOUND_INto/from Garcinia Huillensis (Plant) Rel Props:Reference: - 15. Outgoing r'ship
FOUND_INto/from Garcinia Indica (Plant) Rel Props:Reference: - 16. Outgoing r'ship
FOUND_INto/from Garcinia Intermedia (Plant) Rel Props:Reference: - 17. Outgoing r'ship
FOUND_INto/from Garcinia Kola (Plant) Rel Props:Reference: - 18. Outgoing r'ship
FOUND_INto/from Garcinia Kydia (Plant) Rel Props:Reference: - 19. Outgoing r'ship
FOUND_INto/from Garcinia Lancaeafolia (Plant) Rel Props:Reference: - 20. Outgoing r'ship
FOUND_INto/from Garcinia Lancilimba (Plant) Rel Props:Reference: - 21. Outgoing r'ship
FOUND_INto/from Garcinia Lateriflora (Plant) Rel Props:Reference: - 22. Outgoing r'ship
FOUND_INto/from Garcinia Latissima (Plant) Rel Props:Reference: - 23. Outgoing r'ship
FOUND_INto/from Garcinia Linii (Plant) Rel Props:Reference: - 24. Outgoing r'ship
FOUND_INto/from Garcinia Livingstonei (Plant) Rel Props:Reference: - 25. Outgoing r'ship
FOUND_INto/from Garcinia Lucida (Plant) Rel Props:Reference: - 26. Outgoing r'ship
FOUND_INto/from Garcinia Macrophylla (Plant) Rel Props:Reference: - 27. Outgoing r'ship
FOUND_INto/from Garcinia Mangostana (Plant) Rel Props:Reference: - 28. Outgoing r'ship
FOUND_INto/from Garcinia Morella (Plant) Rel Props:Reference: - 29. Outgoing r'ship
FOUND_INto/from Garcinia Multiflora (Plant) Rel Props:Reference: - 30. Outgoing r'ship
FOUND_INto/from Garcinia Nervosa (Plant) Rel Props:Reference: - 31. Outgoing r'ship
FOUND_INto/from Garcinia Nigrolineata (Plant) Rel Props:Reference: - 32. Outgoing r'ship
FOUND_INto/from Garcinia Oblongifolia (Plant) Rel Props:Reference: - 33. Outgoing r'ship
FOUND_INto/from Garcinia Oligantha (Plant) Rel Props:Reference: - 34. Outgoing r'ship
FOUND_INto/from Garcinia Ovalifolia (Plant) Rel Props:Reference: - 35. Outgoing r'ship
FOUND_INto/from Garcinia Parvifolia (Plant) Rel Props:Reference: - 36. Outgoing r'ship
FOUND_INto/from Garcinia Paucinervis (Plant) Rel Props:Reference: - 37. Outgoing r'ship
FOUND_INto/from Garcinia Pedunculata (Plant) Rel Props:Reference: - 38. Outgoing r'ship
FOUND_INto/from Garcinia Polyantha (Plant) Rel Props:Reference: - 39. Outgoing r'ship
FOUND_INto/from Garcinia Pseudoguttifera (Plant) Rel Props:Reference: - 40. Outgoing r'ship
FOUND_INto/from Garcinia Purpurea (Plant) Rel Props:Reference: - 41. Outgoing r'ship
FOUND_INto/from Garcinia Pyrifera (Plant) Rel Props:Reference: - 42. Outgoing r'ship
FOUND_INto/from Garcinia Quaesita (Plant) Rel Props:Reference: - 43. Outgoing r'ship
FOUND_INto/from Garcinia Scortechinii (Plant) Rel Props:Reference: - 44. Outgoing r'ship
FOUND_INto/from Garcinia Speciosa (Plant) Rel Props:Reference: - 45. Outgoing r'ship
FOUND_INto/from Garcinia Spicata (Plant) Rel Props:Reference: - 46. Outgoing r'ship
FOUND_INto/from Garcinia Subelliptica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 47. Outgoing r'ship
FOUND_INto/from Garcinia Talbotii (Plant) Rel Props:Reference: - 48. Outgoing r'ship
FOUND_INto/from Garcinia Tinctoria (Plant) Rel Props:Reference: - 49. Outgoing r'ship
FOUND_INto/from Garcinia Travancorica (Plant) Rel Props:Reference: - 50. Outgoing r'ship
FOUND_INto/from Garcinia Virgata (Plant) Rel Props:Reference: - 51. Outgoing r'ship
FOUND_INto/from Garcinia Wightii (Plant) Rel Props:Reference: - 52. Outgoing r'ship
FOUND_INto/from Garcinia Xanthochymus (Plant) Rel Props:Reference: - 53. Outgoing r'ship
FOUND_INto/from Garcinia Xipshuanbannaensis (Plant) Rel Props:Reference: