35 Known Ingredients in Total


Unique ingredients have been isolated from this plant.
Plant-Ingredients Associations were manually curated from publications or collected from other databases.



10 Ingredients with Available Activity


Unique ingredients have activity data available.


Ingredient Structrual Cards

Ingredient ID: NPC84786
Formula: C20H26O4

Ingredient ID: NPC75457
Formula: C20H30O2

Ingredient ID: NPC71074
Formula: C30H48O4

Ingredient ID: NPC66333
Formula: C22H28O6

Ingredient ID: NPC52289
Formula: C19H22O4

Ingredient ID: NPC45462
Formula: C20H24O5

Ingredient ID: NPC4051
Formula: C21H32O3

Ingredient ID: NPC302462
Formula: C20H26O5

Ingredient ID: NPC293454
Formula: C20H28O4

Ingredient ID: NPC28804
Formula: C21H30O3

Ingredient ID: NPC286880
Formula: C20H24O5

Ingredient ID: NPC249078
Formula: C15H26O2

Ingredient ID: NPC248068
Formula: C20H28O4

Ingredient ID: NPC247928
Formula: C22H28O6

Ingredient ID: NPC246229
Formula: C21H28O5

Ingredient ID: NPC230691
Formula: C20H26O6

Ingredient ID: NPC225518
Formula: C19H26O5

Ingredient ID: NPC22502
Formula: C21H28O6

Ingredient ID: NPC224878
Formula: C21H28O6

Ingredient ID: NPC223573
Formula: C20H24O5

Ingredient ID: NPC217156
Formula: C40H52O8

Ingredient ID: NPC210327
Formula: C30H50

Ingredient ID: NPC198868
Formula: C22H30O5

Ingredient ID: NPC191899
Formula: C22H30O5

Ingredient ID: NPC182442
Formula: C21H32O3

Ingredient ID: NPC176130
Formula: C20H28O2

Ingredient ID: NPC16430
Formula: C24H34O4

Ingredient ID: NPC152152
Formula: C21H28O5

Ingredient ID: NPC142167
Formula: C15H26O2

Ingredient ID: NPC127046
Formula: C20H26O5

Ingredient ID: NPC126707
Formula: C20H26O5

Ingredient ID: NPC11917
Formula: C20H26O6

Ingredient ID: NPC111845
Formula: C20H28O3

Ingredient ID: NPC110364
Formula: C23H32O4

Ingredient ID: NPC109813
Formula: C15H24

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC109813 C15H24 Beta-Caryophyllene 204.19 3.2289 3.11 6.044 0 0 0 3 2 15 1
NPC110364 C23H32O4 methyl (4aR,10aS)-5,6-dimethoxy-1,1-dimethyl-7-propan-2-yl-2,3,4,10a-tetrahydrophenanthrene-4a-carboxylate 372.2300595 1.328 3.55 5.959 2 0 44.76 5 3 27 1
NPC111845 C20H28O3 Demethylcryptojaponol 316.2 0.3156 3.33 5.549 1 2 57.53 8 3 23 1
NPC11917 C20H26O6 362.1729386 -1.2322 3 2.772 4 4 115.06 2 3 26 0
NPC126707 C20H26O5 Rosmanol 346.18 -0.7496 3.11 3.31 3 3 86.99 8 4 25 0
NPC127046 C20H26O5 Isorosmanol 346.18 -0.7496 3.11 3.31 3 3 86.99 8 2 25 0
NPC142167 C15H26O2 238.1932801 0.2753 2.89 3.13 2 2 40.46 0 3 17 0
NPC152152 C21H28O5 360.193674 -0.3152 3.22 4.009 3 2 83.83 3 3 26 0
NPC16430 C24H34O4 386.2457096 1.8584 3.66 7.606 3 0 52.6 5 3 28 1
NPC176130 C20H28O2 Sugiol 300.21 0.7759 3.44 6.294 1 1 37.3 7 3 22 1
NPC182442 C21H32O3 (6aS,10aS)-2-methoxy-7,7-dimethyl-3-propan-2-yl-6,6a,8,9,10,11-hexahydro-5H-dibenzo[3,1-d:4',5'-e][7]annulene-1,10a-diol 332.2351449 0.8647 3.44 5.132 1 2 49.69 2 3 24 1
NPC191899 C22H30O5 374.2093241 -0.0907 3.33 4.252 3 2 75.99 10 4 27 0
NPC198868 C22H30O5 374.2093241 0.3599 3.33 5.494 3 2 83.83 4 3 27 1
NPC210327 C30H50 410.3912516 8.0112 4.76 11.989 0 0 0 16 0 30 2
NPC217156 C40H52O8 660.3662186 -0.1598 4.98 9.313 4 4 133.52 5 7 48 1
NPC223573 C20H24O5 344.1623739 -0.6094 3.11 3.533 3 2 83.83 1 4 25 0
NPC224878 C21H28O6 376.1885886 -0.9812 3.11 3.093 4 3 104.06 3 3 27 0
NPC22502 C21H28O6 376.1885886 -0.9812 3.11 3.093 4 3 104.06 3 3 27 0
NPC225518 C19H26O5 334.1780239 0.3016 3 3.505 3 3 86.99 2 3 24 0
NPC230691 C20H26O6 362.1729386 -1.2322 3 2.772 4 4 115.06 2 3 26 0
NPC246229 C21H28O5 360.19 -0.3411 3.22 3.829 3 2 75.99 9 4 26 0
NPC247928 C22H28O6 388.1885886 0.088 3.22 3.846 6 1 89.9 3 4 28 0
NPC248068 C20H28O4 332.1987594 -0.3366 3.22 5.003 2 3 77.76 9 3 24 1
NPC249078 C15H26O2 238.1932801 0.2753 2.89 3.13 2 2 40.46 5 3 17 0
NPC286880 C20H24O5 Rosmaquinone 344.16 -0.0078 3.11 2.556 5 1 80.67 6 4 25 0
NPC28804 C21H30O3 330.2194948 0.3738 3.44 5.146 1 1 38.69 2 2 24 1
NPC293454 C20H28O4 Carnosic Acid 332.2 -0.0192 3.22 5.183 2 3 77.76 9 3 24 1
NPC302462 C20H26O5 346.1780239 -0.8715 3.11 2.997 3 3 86.99 2 2 25 0
NPC4051 C21H32O3 332.2351449 0.8647 3.44 5.132 1 2 49.69 2 3 24 1
NPC45462 C20H24O5 344.1623739 -0.6094 3.11 3.533 3 2 83.83 1 4 25 0
NPC52289 C19H22O4 5,6,9-trihydroxy-1,1-dimethyl-7-propan-2-yl-2,3-dihydrophenanthren-4-one 314.1518092 -0.0604 3.11 3.409 1 3 77.76 1 3 23 0
NPC66333 C22H28O6 388.1885886 -0.4924 3.22 3.737 4 2 93.06 4 2 28 0
NPC71074 C30H48O4 Corosolic Acid 472.36 1.2611 4.32 8.142 4 3 77.76 11 5 34 1
NPC75457 C20H30O2 (3S,4aS,10aR)-1,1,4a-trimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-3,6-diol 302.2245802 1.1002 3.44 6.126 1 2 40.46 1 3 22 1
NPC84786 C20H26O4 Carnosol 330.18 0.0167 3.22 4.551 2 2 66.76 7 2 24 0

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1. General Information & structure data (InChi, InChiKey, SMILES)  
2. Physico-chemical Properties