Taraxasteryl-acetate

PubChem CID: 67496301

Connections displayed (default: 10).

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Compound Synonyms	taraxasteryl-acetate, SCHEMBL2683976
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0.0
Heavy Atom Count	34.0
Isotope Atom Count	0.0
Molecular Complexity	872.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	7.0
Iupac Name	[(6aR,6aR,6bR,8aR,12aR,14aR,14bR)-4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-1,2,3,4a,5,6,6a,7,8,9,10,12,12a,13,14,14a-hexadecahydropicen-3-yl] acetate
Prediction Hob	1.0
Xlogp	9.7
Molecular Formula	C32H52O2
Prediction Swissadme	0.0
Inchi Key	SFEUTIOWNUGQMZ-IMVDQKSJSA-N
Fcsp3	0.90625
Logs	-6.854
Rotatable Bond Count	2.0
Logd	5.966
Compound Name	Taraxasteryl-acetate
Prediction Hob Swissadme	0.0
Exact Mass	468.397
Formal Charge	0.0
Monoisotopic Mass	468.397
Hydrogen Bond Acceptor Count	2.0
Molecular Weight	468.8
Covalent Unit Count	1.0
Total Atom Stereocenter Count	10.0
Total Bond Stereocenter Count	0.0
Esol	-8.725349200000002
Inchi	InChI=1S/C32H52O2/c1-20-12-15-29(6)18-19-31(8)23(27(29)21(20)2)10-11-25-30(7)16-14-26(34-22(3)33)28(4,5)24(30)13-17-32(25,31)9/h21,23-27H,1,10-19H2,2-9H3/t21?,23-,24?,25-,26?,27-,29-,30+,31-,32-/m1/s1
Smiles	CC1[C@@H]2[C@H]3CC[C@@H]4[C@]5(CCC(C(C5CC[C@]4([C@@]3(CC[C@]2(CCC1=C)C)C)C)(C)C)OC(=O)C)C
Nring	5.0
Defined Bond Stereocenter Count	0.0

1. Outgoing r'ship FOUND_IN to/from Achyranthes Japonica (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Agrimonia Japonica (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Agrimonia Pilosa (Plant) Rel Props:Reference:
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7. Outgoing r'ship FOUND_IN to/from Angelica Japonica (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Ardisia Japonica (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Artemisia Japonica (Plant) Rel Props:Reference:
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11. Outgoing r'ship FOUND_IN to/from Aucuba Japonica (Plant) Rel Props:Reference:
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40. Outgoing r'ship FOUND_IN to/from Forsythia Koreana (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Forsythia Suspensa (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
42. Outgoing r'ship FOUND_IN to/from Forsythia Suspense (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Forsythia Viridissima (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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50. Outgoing r'ship FOUND_IN to/from Inula Britannica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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59. Outgoing r'ship FOUND_IN to/from Inula Japonica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
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77. Outgoing r'ship FOUND_IN to/from Mentha Japonica (Plant) Rel Props:Reference:
78. Outgoing r'ship FOUND_IN to/from Metaplexis Japonica (Plant) Rel Props:Reference:
79. Outgoing r'ship FOUND_IN to/from Micromeria Japonica (Plant) Rel Props:Reference:
80. Outgoing r'ship FOUND_IN to/from Microtropis Japonica (Plant) Rel Props:Reference:
81. Outgoing r'ship FOUND_IN to/from Mosla Japonica (Plant) Rel Props:Reference:
82. Outgoing r'ship FOUND_IN to/from Murdannia Japonica (Plant) Rel Props:Reference:
83. Outgoing r'ship FOUND_IN to/from Ophiorrhiza Japonica (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Orixa Japonica (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Osmunda Japonica (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Pieris Japonica (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Plagiochila Acanthophylla (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Prunus Japonica (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Pseudotsuga Japonica (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Pteris Japonica (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Pyrola Japonica (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Ranzania Japonica (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Rhamnus Japonica (Plant) Rel Props:Reference:
94. Outgoing r'ship FOUND_IN to/from Rohdea Japonica (Plant) Rel Props:Reference:
95. Outgoing r'ship FOUND_IN to/from Sabia Japonica (Plant) Rel Props:Reference:
96. Outgoing r'ship FOUND_IN to/from Sagina Japonica (Plant) Rel Props:Reference:
97. Outgoing r'ship FOUND_IN to/from Salix Japonica (Plant) Rel Props:Reference:
98. Outgoing r'ship FOUND_IN to/from Saussurea Japonica (Plant) Rel Props:Reference:
99. Outgoing r'ship FOUND_IN to/from Scopolia Japonica (Plant) Rel Props:Reference:
100. Outgoing r'ship FOUND_IN to/from Skimmia Japonica (Plant) Rel Props:Reference:
101. Outgoing r'ship FOUND_IN to/from Sophora Japonica (Plant) Rel Props:Reference:
102. Outgoing r'ship FOUND_IN to/from Spergula Japonica (Plant) Rel Props:Reference:
103. Outgoing r'ship FOUND_IN to/from Spiraea Japonica (Plant) Rel Props:Reference:
104. Outgoing r'ship FOUND_IN to/from Stemona Japonica (Plant) Rel Props:Reference:
105. Outgoing r'ship FOUND_IN to/from Stephania Japonica (Plant) Rel Props:Reference:
106. Outgoing r'ship FOUND_IN to/from Swertia Japonica (Plant) Rel Props:Reference:
107. Outgoing r'ship FOUND_IN to/from Ternstroemia Japonica (Plant) Rel Props:Reference:
108. Outgoing r'ship FOUND_IN to/from Tilia Japonica (Plant) Rel Props:Reference:
109. Outgoing r'ship FOUND_IN to/from Torilis Japonica (Plant) Rel Props:Reference:
110. Outgoing r'ship FOUND_IN to/from Trapa Japonica (Plant) Rel Props:Reference:
111. Outgoing r'ship FOUND_IN to/from Trixis Inula (Plant) Rel Props:Reference:
112. Outgoing r'ship FOUND_IN to/from Youngia Japonica (Plant) Rel Props:Reference:

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Taraxasteryl-acetate

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Phytochemical Properties

Associated Connections 112

Plant Connections 112