Olean-12-en-29-oic acid, 3-hydroxy-11-oxo-, (3beta,20beta)-

PubChem CID: 3230

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Compound Synonyms	enoxolone, Uralenic acid, GLYCYRRHETINIC ACID, Glycyrrhetin, Biosone, 3-Hydroxy-11-oxoolean-12-en-29-oic acid, 3-Glycyrrhetinic acid, .alpha.-Glycyrrhetinic acid, 18.beta.-Glycyrrhetic acid, 18.beta.-Glycyrrhtinic acid, 18.beta.-Glycyrrhetinic acid, NSC35347, NSC35350, 1449-05-4, Olean-12-en-29-oic acid, 3-hydroxy-11-oxo-, (3.beta.,20.beta.)-, Arthrodont, 3.beta.-Hydroxy-11-oxoolean-12-en-30-oic acid, Olean-12-en-30-oic acid, 3.beta.-hydroxy-11-oxo-, 18a-glycyrrhetinic acid, NSC-35350, Glyccyrhetic acid, NCGC00181115-01, .beta.-Glycyrrhetic acid, .beta.-Glycyrrhetinic acid, SCHEMBL25465, 10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid, 18-.beta.-Glycrrhetinic acid, 18.alpha.-Glycyrrhetinic acid, Olean-12-en-29-oic acid, 3-hydroxy-11-oxo-, (3beta,20beta)-, 18-.beta.-Glycyrrhetinic acid, CHEMBL1863561, Glycyrrhetinic acid, 18 alpha-, DTXSID50859383, MPDGHEJMBKOTSU-UHFFFAOYSA-N, BBL009942, GLYCYRRHETINIC ACID,18 ALPHA, STK801355, AKOS005612983, P.O. 12, NCI60_003170, VS-02260, DB-042758, Olean-12-en-29-oic acid, (3.beta.,20.beta.)-, 3.beta.-Hydroxy-11-oxo-18.alpha.-olean-12-en-30-oic acid, Olean-12-en-29-oic acid, (3.beta.,18.alpha.,20.beta.)-, (3.beta.,20.beta.)-3-Hydroxy-11-oxoolean-12-en-29-oic acid, 18.alpha.-olean-12-en-30-oic acid, 3.beta.-hydroxy-11-oxo-, 3-Hydroxy-11-oxoolean-12-en-29-oic acid, (3.beta.,20.beta.)- #, WLN: L F6 E6 B666 CV DUTJ A1 HVQ H1 K1 N1 O1 S1 S1 TQ -.alpha., WLN: L F6 E6 B666 CV DUTJ A1 HVQ H1 K1 N1 O1 S1 S1 TQ -BETA, 10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-2-carboxylic acid
Topological Polar Surface Area	74.6
Hydrogen Bond Donor Count	2.0
Heavy Atom Count	34.0
Description	Saponin from licorice (Glycyrrhiza glabra). Glabranin B is found in tea and herbs and spices.
Isotope Atom Count	0.0
Molecular Complexity	965.0
Database Name	cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Uniprot Id	O94782, O75496, n.a.
Iupac Name	10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid
Prediction Hob	1.0
Class	Prenol lipids
Xlogp	6.4
Superclass	Lipids and lipid-like molecules
Subclass	Triterpenoids
Molecular Formula	C30H46O4
Prediction Swissadme	0.0
Inchi Key	MPDGHEJMBKOTSU-UHFFFAOYSA-N
Fcsp3	0.8666666666666667
Logs	-4.509
Rotatable Bond Count	1.0
Logd	4.605
Synonyms	Glabranin B, 12, Po, Acid, glycyrrhetic, Acid, glycyrrhetinic, Acid, rhetinic, Acid, uralenic, Arthrodont, Enoxolone, Glyciram, Glycyram, Glycyrrhetic acid, Jintan, Po 12, Rhetinic acid, Uralenic acid, Glycyrrhetinic acid
Compound Name	Olean-12-en-29-oic acid, 3-hydroxy-11-oxo-, (3beta,20beta)-
Kingdom	Organic compounds
Prediction Hob Swissadme	0.0
Exact Mass	470.34
Formal Charge	0.0
Monoisotopic Mass	470.34
Hydrogen Bond Acceptor Count	4.0
Molecular Weight	470.7
Covalent Unit Count	1.0
Total Atom Stereocenter Count	9.0
Total Bond Stereocenter Count	0.0
Molecular Framework	Aliphatic homopolycyclic compounds
Esol	-6.151002800000002
Inchi	InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)
Smiles	CC1(C2CCC3(C(C2(CCC1O)C)C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C
Nring	5.0
Defined Bond Stereocenter Count	0.0
Taxonomy Direct Parent	Triterpenoids

1. Outgoing r'ship FOUND_IN to/from Aesculus Glabra (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Angelica Glabra (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Annona Glabra (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Begonia Glabra (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Begonia Inflata (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Boswellia Glabra (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Bougainvillea Glabra (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Cephalaria Uralensis (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Dioscorea Glabra (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Glycyrrhiza (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Aspera (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Echinata (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Glabra (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
14. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Inflata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
15. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Kansuensis (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Lepidota (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Pallidiflora (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Sp (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Squamulosa (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Triphylla (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Uralensis (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
22. Outgoing r'ship FOUND_IN to/from Glycyrrhiza Yunnanensis (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Goupia Glabra (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Herniaria Glabra (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Hopea Glabra (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Horsfieldia Glabra (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Hypochoeris Glabra (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Indigofera Glabra (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Lobelia Inflata (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Malpighia Glabra (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Mussaenda Glabra (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Persicaria Glabra (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Petunia Integrifolia (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Polypodium Glycyrrhiza (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Pongamia Glabra (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Sarcandra Glabra (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Scutellaria Glabra (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Silene Inflata (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Smilax Glabra (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Stephania Glabra (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Thermopsis Inflata (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Ulmus Glabra (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Waldheimia Glabra (Plant) Rel Props:Reference:

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Olean-12-en-29-oic acid, 3-hydroxy-11-oxo-, (3beta,20beta)-

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Phytochemical Properties

Associated Connections 43

Plant Connections 43