33 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: NPC84319
Formula: C30H48O4

Ingredient ID: NPC8180
Formula: C14H22

Ingredient ID: NPC66577
Formula: C15H24

Ingredient ID: NPC55668
Formula: C30H50O3

Ingredient ID: NPC34010
Formula: C30H50O3

Ingredient ID: NPC312903
Formula: C30H52O3

Ingredient ID: NPC311289
Formula: C30H48O4

Ingredient ID: NPC310956
Formula: C30H52O3

Ingredient ID: NPC298062
Formula: C10H18O

Ingredient ID: NPC283655
Formula: C10H18O

Ingredient ID: NPC278128
Formula: C30H52O2

Ingredient ID: NPC277917
Formula: C10H18O

Ingredient ID: NPC270768
Formula: C30H48O4

Ingredient ID: NPC267691
Formula: C30H46O3

Ingredient ID: NPC267517
Formula: C31H48O3

Ingredient ID: NPC263548
Formula: C30H48O5

Ingredient ID: NPC231063
Formula: C30H48O5

Ingredient ID: NPC230754
Formula: C30H46O5

Ingredient ID: NPC220498
Formula: C30H48O4

Ingredient ID: NPC217115
Formula: C31H48O6

Ingredient ID: NPC215843
Formula: C30H50O2

Ingredient ID: NPC214662
Formula: C30H50O3

Ingredient ID: NPC214150
Formula: C30H50O3

Ingredient ID: NPC192582
Formula: C32H50O4

Ingredient ID: NPC189224
Formula: C30H48O5

Ingredient ID: NPC170435
Formula: C30H50O2

Ingredient ID: NPC142415
Formula: C30H48O3

Ingredient ID: NPC117663
Formula: C30H46O6

Ingredient ID: NPC114239
Formula: C10H16

Ingredient ID: NPC109813
Formula: C15H24

Ingredient ID: NPC106591
Formula: C30H52O3

Ingredient ID: NPC105246
Formula: C15H24

Ingredient ID: NPC101475
Formula: C30H50O2

Properties

Ingredient ID Formulae Name MW AlogP MlogP XlogP # HBA # HBD PSA # Rotatable Bond # Ring # Heacy Atom Lipinski RO5 Violation
NPC101475 C30H50O2 Erythrodiol 442.38 1.9209 4.54 9.359 2 2 40.46 10 5 32 1
NPC105246 C15H24 204.1878008 3.2309 3.11 6.071 0 0 0 6 1 15 1
NPC106591 C30H52O3 460.3916455 1.591 4.43 8.928 3 2 49.69 2 5 33 1
NPC109813 C15H24 Beta-Caryophyllene 204.19 3.2289 3.11 6.044 0 0 0 3 2 15 1
NPC114239 C10H16 136.1252005 1.5162 2.56 4.177 0 0 0 3 1 10 0
NPC117663 C30H46O6 (1S,2R,4aS,6aR,6aS,6bR,8aR,9R,10R,11R,12aS,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-13-oxo-1,2,3,4,5,6,6a,7,8,8a,10,11,12,14b-tetradecahydropicene-4a-carboxylic acid 502.3294392 -0.2763 4.1 5.343 6 4 115.06 2 5 36 1
NPC142415 C30H48O3 Oleanolic_Acid 456.36 2.1298 4.43 9.052 3 2 57.53 10 5 33 1
NPC170435 C30H50O2 442.3810808 3.8709 4.54 9.23 2 1 37.3 4 4 32 1
NPC189224 C30H48O5 (1S,2R,4aS,6aR,6aS,6bR,8aS,9R,10R,11R,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-1,2,6a,6b,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid 488.3501746 0.1704 4.21 7.439 5 4 97.99 2 5 35 1
NPC192582 C32H50O4 498.3709101 2.5089 4.54 9.792 4 1 63.6 3 5 36 1
NPC214150 C30H50O3 458.3759955 2.9827 4.43 8.098 3 2 57.53 5 4 33 1
NPC214662 C30H50O3 458.3759955 2.1607 4.43 8.321 3 1 46.53 2 5 33 1
NPC215843 C30H50O2 442.3810808 3.8709 4.54 9.23 2 1 37.3 13 4 32 1
NPC217115 C31H48O6 516.3450893 -0.0253 4.21 5.664 6 3 104.06 3 5 37 1
NPC220498 C30H48O4 Alphitolic Acid 472.36 2.1268 4.32 8.595 4 3 77.76 11 5 34 1
NPC230754 C30H46O5 486.3345246 0.1674 4.21 6.369 5 3 86.99 1 6 35 1
NPC231063 C30H48O5 Arjunolic Acid 488.35 0.8164 4.21 7.537 5 4 97.99 12 5 35 1
NPC263548 C30H48O5 Asiatic Acid 488.35 0.1704 4.21 7.439 5 4 97.99 12 5 35 1
NPC267517 C31H48O3 Methyl 3-Oxo-Olean-12-En-28-Oate 468.36 2.9505 4.54 8.766 3 0 43.37 10 5 34 1
NPC267691 C30H46O3 Oleanonic Acid 454.34 2.6995 4.43 8.445 3 1 54.37 9 5 33 1
NPC270768 C30H48O4 Hederagenin 472.36 1.0391 4.32 8.349 4 3 77.76 11 5 34 1
NPC277917 C10H18O 154.1357652 0.9432 2.45 2.734 1 1 20.23 4 2 11 0
NPC278128 C30H52O2 444.3967309 3.3012 4.54 9.837 2 2 40.46 4 4 32 1
NPC283655 C10H18O 154.1357652 0.9432 2.45 2.734 1 1 20.23 4 2 11 0
NPC298062 C10H18O (1S,3S,4S)-4,7,7-trimethylbicyclo[2.2.1]heptan-3-ol 154.1357652 0.9432 2.45 2.734 1 1 20.23 0 2 11 0
NPC310956 C30H52O3 (3S,5R,8R,9R,10R,13R,14R,17S)-17-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol 460.3916455 1.591 4.43 8.928 3 2 49.69 2 5 33 1
NPC311289 C30H48O4 472.35526 2.1268 4.32 8.595 4 3 77.76 2 5 34 1
NPC312903 C30H52O3 460.3916455 1.591 4.43 8.928 3 2 49.69 2 5 33 1
NPC34010 C30H50O3 (5R,8R,9R,10R,13R,14R,17S)-17-[(2S)-1,2-dihydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-1,2,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 458.3759955 2.9827 4.43 8.098 3 2 57.53 5 4 33 1
NPC55668 C30H50O3 (5R,8R,9S,10R,13R,14R,17S)-17-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-4,4,8,10,14-pentamethyl-1,2,5,6,7,9,11,12,13,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 458.3759955 2.1607 4.43 8.321 3 1 46.53 2 5 33 1
NPC66577 C15H24 204.1878008 4.1708 3.11 5.94 0 0 0 4 1 15 1
NPC8180 C14H22 (1R,4Z,8S)-4,10,10-trimethyl-7-methylidenebicyclo[6.2.0]dec-4-ene 190.1721507 3.2321 3 5.664 0 0 0 0 2 14 1
NPC84319 C30H48O4 Maslinic Acid 472.36 1.9071 4.32 8.24 4 3 77.76 11 5 34 1

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