Compound Summary
Compound Information
URSODEOXYCHOLIC ACID
Compound Name: | URSODEOXYCHOLIC ACID |
Compound CID: | 31401 |
Synonyms: | URSODEOXYCHOLIC ACID ursodiol 128-13-2 Actigall ursodeoxycholate More... |
Iupac Name: | (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid |
InChI: | InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20+,22+,23+,24-/m1/s1 |
InChIKey: | RUDATBOHQWOJDD-UZVSRGJWSA-N |
Canonical Smiles: | CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C |
Isomeric Smiles: | C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C |
Molecular Weight: | 392.6 |
Molecular Formula: | C24H40O4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
URSODEOXYCHOLIC ACID
Molecular Weight: | 392.6 |
Molecular Formula: | C24H40O4 |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 4 |
Heavy Atom Count: | 28 |
Complexity: | 605 |
Synonyms
URSODEOXYCHOLIC ACID
| URSODEOXYCHOLIC ACID | URSODEOXYCHOLIC ACID |
|---|---|
URSODEOXYCHOLIC ACID |
ursodiol |
128-13-2 |
Actigall |
ursodeoxycholate |
UDCA |
Ursofalk |
Ursolvan |
Delursan |
UrSO |
Urso Forte |
Ursodesoxycholic acid |
Destolit |
Ursochol |
Cholit-ursan |
Litursol |
Solutrat |
Ursobilin |
Ursodamor |
Arsacol |
Deursil |
Lyeton |
Ursacol |
Urso DS |
UDCS |
3alpha,7beta-Dihydroxy-5beta-cholan-24-oic acid |
Ursosan |
Ursodexycholic Acid |
Urso 250 |
7-beta-Hydroxylithocholic acid |
3-alpha,7-beta-Dioxycholanic acid |
Ursocholic acid, deoxy- |
3-alpha,7-beta-Dihydroxycholanic acid |
NSC 683769 |
(3alpha,5beta,7beta)-3,7-dihydroxycholan-24-oic acid |
3-alpha,7-beta-Dihydroxy-5-beta-cholanoic acid |
Ursodeoxycholicacid |
NSC 657950 |
UNII-724L30Y2QR |
BRN 3219888 |
MFCD00003680 |
Peptarom |
CHEMBL1551 |
Ursodesoxycholic acid (UDCA) |
MLS000028461 |
CHEBI:9907 |
724L30Y2QR |
(4R)-4-(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopentaaphenanthren-17-ylpentanoic acid |
Antigall |
SMR000058403 |
Urosiol |
Acido ursodeossicolico Italian |
(R)-4-((3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopentaaphenanthren-17-yl)pentanoic acid |
Acido ursodeoxicolico |
Acido ursodeossicolico |
Acido ursodeoxicolico INN-Spanish |
Acidum ursodeoxycholicum INN-Latin |
Acide ursodesoxycholique |
Acide ursodesoxycholique INN-French |
Acidum ursodeoxycholicum |
7beta-Hydroxylithocholic acid |
Actigall (TN) |
Ursodiol (USP) |
(4R)-4-(1S,2S,5R,7S,9S,10R,11S,14R,15R)-5,9-dihydroxy-2,15-dimethyltetracyclo8.7.0.0^{2,7}.0^{11,15}heptadecan-14-ylpentanoic acid |
CCRIS 5502 |
Urso (TN) |
SR-01000737091 |
Ursodiol USAN:USP |
EINECS 204-879-3 |
Ursodexycholate |
Paptarom |
Ursonorm |
Udiliv |
Desol |
Urdes |
Urosdesoxycholate |
5beta-Cholan-24-oic acid-3alpha,7beta-diol |
NSC-683769 |
17-beta-(1-Methyl-3-carboxypropyl)etiocholane-3-alpha,7-beta-diol |
Ursodeoxycholoc acid |
Urosdesoxycholic acid |
5beta-Cholanic Acid-3alpha,7beta-diol |
Ursodesoxy cholic acid |
Cholan-24-oic acid, 3,7-dihydroxy-, (3alpha,5beta,7beta)- |
3alpha,7beta-Dihydroxy-5beta-cholanic acid |
Ursodiol (Actigal Urso) |
Prestwick0_000958 |
Prestwick1_000958 |
Prestwick2_000958 |
Prestwick3_000958 |
U0030 |
7A-Hydroxylithocholic acid |
EC 204-879-3 |
U-9000 |
Ursodeoxycholic acid INN |
SCHEMBL27200 |
5-beta-Cholan-24-oic acid |
BSPBio_000956 |
4-10-00-01604 (Beilstein Handbook Reference) |
7bet.-Hydroxylithocholic acid |
cid_31401 |
MLS001066373 |
MLS002548885 |
SPBio_003105 |
Ursodeoxycholic acid, >=99% |
BPBio1_001052 |
GTPL7104 |
7.beta.-Hydroxylithocholic acid |
Ursodiol (Ursodeoxycholic Acid) |
5-beta-Cholan-24-oic acid, 3-alpha,7-beta-dihydroxy- |
DTXSID6023731 |
BDBM53721 |
AOB5075 |
(3alpha,5beta,7beta,8xi)-3,7-dihydroxycholan-24-oic acid |
HMS1570P18 |
HMS2097P18 |
HMS2233L14 |
HMS3259A13 |
HMS3714P18 |
Ursodeoxycholic acid (JP17/INN) |
3alpha,7beta-dihydroxycholanic acid |
ACT02676 |
ZINC3914809 |
3a,7b-dihydroxy-5b-cholan-24-oate |
Cholan-24-oic acid, 3,7-dihydroxy-, (3.alpha.,5.beta.,7.beta.)- |
LMST04010033 |
s1643 |
5A-Cholan-24-oic acid-3A,7A-diol |
AKOS015955898 |
CCG-220958 |
CS-1932 |
DB01586 |
KS-5243 |
MCULE-4374611501 |
NC00487 |
SMP2_000012 |
3.alpha.,7.beta.-Dihydroxycholanic acid |
3A,7A-Dihydroxy-5A-holan-24-oic acid |
3a,7b-dihydroxy-5b-cholan-24-oic acid |
NCGC00179363-01 |
NCGC00179363-12 |
AC-18919 |
CAS#128-13-2 |
CPD000058403 |
HY-13771 |
NCI60_028904 |
AB00513977 |
(3a,5b,7b)-3,7-dihydroxy-cholan-24-oate |
3alpha, 7beta-dihydroxy-5beta-cholanoic acid |
5bet.-Cholan-24-oic acid-3alp.,7bet.-diol |
(3a,5b,7b)-3,7-dihydroxycholan-24-oic acid |
C07880 |
D00734 |
J10139 |
((3a,5b,7b)-3,7-Dihydroxycholan-24-oic acid |
(3a,5b,7b)-3,7-dihydroxy-cholan-24-oic acid |
AB00513977-09 |
AB00513977_10 |
3alp.,7bet.-Dihydroxy-5bet.-cholan-24-oic acid |
A905413 |
Q241374 |
3.alpha.,7.beta.-Dihydroxy-5.beta.-cholanic acid |
J-005566 |
J-650210 |
SR-01000737091-3 |
SR-01000737091-4 |
BRD-K15697815-001-16-2 |
3.alpha.,7.beta.-Dihydroxy-5.beta.-cholan-24-oic acid |
Z2786051717 |
5.beta.-Cholan-24-oic acid, 3.alpha.,7.beta.-dihydroxy- |
Ursodiol, United States Pharmacopeia (USP) Reference Standard |
Ursodeoxycholic acid, British Pharmacopoeia (BP) Reference Standard |
Ursodeoxycholic acid, European Pharmacopoeia (EP) Reference Standard |
17.beta.-(1-Methyl-3-carboxypropyl)etiocholane-3.alpha.,7.beta.-diol |
3,7-Dihydroxycholan-24-oic acid-, (3.alpha.,5.beta.,7.beta.)- # |
Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-beta)- (9CI) |
Ursodeoxycholic acid, 500 mug/mL in methanol, certified reference material |
Ursodiol, Pharmaceutical Secondary Standard; Certified Reference Material |
Ursodeoxycholic acid for system suitability, European Pharmacopoeia (EP) Reference Standard |
(4R)-4-(1S,2S,5R,7S,9S,10R,11S,14R,15R)-5,9-Dihydroxy-2,15-dimethyltetracyclo8.7.0.02,1.011,1heptadecan-14-ylpentanoic acid |
(4R)-4-(3R,5S,7S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-bis(oxidanyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopentaaphenanthren-17-ylpentanoic acid |
(4R)-4-(3R,5S,7S,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopentaaphenanthren-17-ylvaleric acid |
108609-27-4 |
Experimental Data
URSODEOXYCHOLIC ACID
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Mus musculus | 5000 | ppm | 780 | 832 | 7 | 1064 | 1063 | 0 | NS | C2011 | MALES | 27312235 | Inactive |
| Mus musculus | 5000 | ppm | 874 | 865 | -1 | 1092 | 1105 | 1 | NS | C2011 | FEMALES | 27312235 | Inactive |
Experimental Data Visualization
URSODEOXYCHOLIC ACID
Statistics Data
URSODEOXYCHOLIC ACID
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Mus musculus | 7 | 1 | 1 | 2 |
Statistics Data Visualization
URSODEOXYCHOLIC ACID
