(2E,4Z,6R)-6-[(1'aR,3R,3'R,3aS,3'aR,6S,7aR,7'aS)-6-hydroxy-3',3a,3'a,7,7-pentamethyl-6'-oxospiro[1,2,4,5,6,7a-hexahydroindene-3,7'-1a,2,4,5-tetrahydroindeno[3,3a-b]oxirene]-3'-yl]-2-methylhepta-2,4-dienoic acid

PubChem CID: 21574221

Connections displayed (default: 10).

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Compound Synonyms	CHEMBL519885
Topological Polar Surface Area	87.1
Hydrogen Bond Donor Count	2.0
Heavy Atom Count	35.0
Isotope Atom Count	0.0
Molecular Complexity	1030.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	9.0
Iupac Name	(2E,4Z,6R)-6-[(1'aR,3R,3'R,3aS,3'aR,6S,7aR,7'aS)-6-hydroxy-3',3a,3'a,7,7-pentamethyl-6'-oxospiro[1,2,4,5,6,7a-hexahydroindene-3,7'-1a,2,4,5-tetrahydroindeno[3,3a-b]oxirene]-3'-yl]-2-methylhepta-2,4-dienoic acid
Prediction Hob	0.0
Xlogp	5.2
Molecular Formula	C30H44O5
Prediction Swissadme	0.0
Inchi Key	UONZCNGOTPYRMX-LBUWXADRSA-N
Fcsp3	0.8
Logs	-4.373
Rotatable Bond Count	4.0
Logd	2.668
Compound Name	(2E,4Z,6R)-6-[(1'aR,3R,3'R,3aS,3'aR,6S,7aR,7'aS)-6-hydroxy-3',3a,3'a,7,7-pentamethyl-6'-oxospiro[1,2,4,5,6,7a-hexahydroindene-3,7'-1a,2,4,5-tetrahydroindeno[3,3a-b]oxirene]-3'-yl]-2-methylhepta-2,4-dienoic acid
Prediction Hob Swissadme	0.0
Exact Mass	484.319
Formal Charge	0.0
Monoisotopic Mass	484.319
Hydrogen Bond Acceptor Count	5.0
Molecular Weight	484.7
Covalent Unit Count	1.0
Total Atom Stereocenter Count	9.0
Total Bond Stereocenter Count	2.0
Esol	-5.844397400000001
Inchi	InChI=1S/C30H44O5/c1-18(24(33)34)9-8-10-19(2)27(6)17-23-30(35-23)28(27,7)15-13-22(32)29(30)16-11-20-25(3,4)21(31)12-14-26(20,29)5/h8-10,19-21,23,31H,11-17H2,1-7H3,(H,33,34)/b10-8-,18-9+/t19-,20+,21+,23-,26+,27-,28-,29-,30+/m1/s1
Smiles	C[C@H](/C=C\C=C(/C)\C(=O)O)[C@]1(C[C@@H]2[C@@]3([C@@]1(CCC(=O)[C@@]34CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)O2)C
Nring	5.0
Defined Bond Stereocenter Count	2.0

1. Outgoing r'ship FOUND_IN to/from Argyreia Speciosa (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Asclepias Speciosa (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Chaenomeles Speciosa (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Erythrina Speciosa (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Garcinia Atroviridis (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Garcinia Cambogia (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Garcinia Cantleyana (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Garcinia Celebica (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Garcinia Conrauana (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Garcinia Cowa (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Garcinia Dulcis (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Garcinia Echinocarpa (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Garcinia Esculenta (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Garcinia Gaudichaudii (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Garcinia Griffithii (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Garcinia Hanburyi (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Garcinia Hombroniana (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Garcinia Huillensis (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Garcinia Indica (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Garcinia Intermedia (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Garcinia Kola (Plant) Rel Props:Reference:
22. Outgoing r'ship FOUND_IN to/from Garcinia Kydia (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Garcinia Lancaeafolia (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Garcinia Lancilimba (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Garcinia Lateriflora (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Garcinia Latissima (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Garcinia Linii (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Garcinia Livingstonei (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Garcinia Lucida (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Garcinia Macrophylla (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Garcinia Mangostana (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Garcinia Morella (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Garcinia Multiflora (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Garcinia Nervosa (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Garcinia Nigrolineata (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Garcinia Oblongifolia (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Garcinia Oligantha (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Garcinia Ovalifolia (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Garcinia Parvifolia (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Garcinia Paucinervis (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Garcinia Pedunculata (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Garcinia Polyantha (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Garcinia Pseudoguttifera (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Garcinia Purpurea (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Garcinia Pyrifera (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Garcinia Quaesita (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Garcinia Scortechinii (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Garcinia Speciosa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
49. Outgoing r'ship FOUND_IN to/from Garcinia Spicata (Plant) Rel Props:Reference:
50. Outgoing r'ship FOUND_IN to/from Garcinia Subelliptica (Plant) Rel Props:Reference:
51. Outgoing r'ship FOUND_IN to/from Garcinia Talbotii (Plant) Rel Props:Reference:
52. Outgoing r'ship FOUND_IN to/from Garcinia Tinctoria (Plant) Rel Props:Reference:
53. Outgoing r'ship FOUND_IN to/from Garcinia Travancorica (Plant) Rel Props:Reference:
54. Outgoing r'ship FOUND_IN to/from Garcinia Virgata (Plant) Rel Props:Reference:
55. Outgoing r'ship FOUND_IN to/from Garcinia Wightii (Plant) Rel Props:Reference:
56. Outgoing r'ship FOUND_IN to/from Garcinia Xanthochymus (Plant) Rel Props:Reference:
57. Outgoing r'ship FOUND_IN to/from Garcinia Xipshuanbannaensis (Plant) Rel Props:Reference:
58. Outgoing r'ship FOUND_IN to/from Guettarda Speciosa (Plant) Rel Props:Reference:
59. Outgoing r'ship FOUND_IN to/from Hymenocallis Speciosa (Plant) Rel Props:Reference:
60. Outgoing r'ship FOUND_IN to/from Lagerstroemia Speciosa (Plant) Rel Props:Reference:
61. Outgoing r'ship FOUND_IN to/from Mitragyna Speciosa (Plant) Rel Props:Reference:
62. Outgoing r'ship FOUND_IN to/from Orobanche Speciosa (Plant) Rel Props:Reference:
63. Outgoing r'ship FOUND_IN to/from Prunus Speciosa (Plant) Rel Props:Reference:
64. Outgoing r'ship FOUND_IN to/from Sesbania Speciosa (Plant) Rel Props:Reference:
65. Outgoing r'ship FOUND_IN to/from Telekia Speciosa (Plant) Rel Props:Reference:
66. Outgoing r'ship FOUND_IN to/from Ursinia Speciosa (Plant) Rel Props:Reference:

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(2E,4Z,6R)-6-[(1'aR,3R,3'R,3aS,3'aR,6S,7aR,7'aS)-6-hydroxy-3',3a,3'a,7,7-pentamethyl-6'-oxospiro[1,2,4,5,6,7a-hexahydroindene-3,7'-1a,2,4,5-tetrahydroindeno[3,3a-b]oxirene]-3'-yl]-2-methylhepta-2,4-dienoic acid

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Phytochemical Properties

Associated Connections 66

Plant Connections 66