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3a,7a-Dihydroxy-5b,14a,17b-cholanic acid

View entire compound with spectra: 5 NMR, and 5 MS (GC)

3a,7a-Dihydroxy-5b,14a,17b-cholanic acid
SpectraBase Compound ID 5swRDFA7bMS
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)
InChIKey RUDATBOHQWOJDD-UHFFFAOYSA-N
Mol Weight 392.6 g/mol
Molecular Formula C24H40O4
Exact Mass 392.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 47KOH4WsbI
Name Cholan-24-oic acid, 3,7-dihydroxy-, (3.alpha.,5.beta.,7.alpha.)-
Alternate Name(s) Cholan-24-oic acid, 3,7-dihydroxy-, (3.alpha.,5.beta.,7.beta.)- 3,7-Dihydroxycholan-24-oic acid 3.alpha.,7.alpha.-Dihydroxy-5.beta.-cholan-24-oic acid 3.alpha.,7.alpha.-Dihydroxy-5.beta.-cholanic acid 3.alpha.,7.alpha.-Dihydroxy-5.beta.-cholanoic acid 3.alpha.,7.alpha.-Dihydroxycholanic acid 3.alpha.,7.beta.-Dihydroxy-5.beta.-cholan-24-oic acid 3.alpha.,7.beta.-Dihydroxy-5.beta.-cholanic acid 4-(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 4-(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)valeric acid 4-[10,13-dimethyl-3,7-bis(oxidanyl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid 5.beta.-Cholan-24-oic acid, 3.alpha.,7.alpha.-dihydroxy- 5.beta.-Cholan-24-oic acid, 3.alpha.,7.beta.-dihydroxy- Acide chenodeoxycholique Acide ursodesoxycholique Acido chenodeoxicholico Acido ursodeossicolico Acido ursodeoxicolico Acidum chenodeoxycholicum Acidum ursodeoxycholicum Actigall Anthropodeoxycholic acid Anthropodesoxycholic acid Anthropododesoxycholic acid Antigall Arsacol CDC CDCA Chendal Chendol Chenic acid Chenix Chenocedon Chenocol Chenodeoxycholate Chenodeoxycholic acid Chenodesoxycholic acid Chenodesoxycholsaeure Chenodex Chenodiol Chenofalk Chenossil Cholan-24-oic acid, 3,7-dihydroxy-, (3-.alpha., 5-.beta., 7-.alpha.)- Cholan-24-oic acid, 3,7-dihydroxy-, (3-.alpha.,5-.beta., 7-.beta.)- Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-alpha)- Cholan-24-oic acid, 3,7-dihydroxy-, (3-alpha,5-beta,7-beta)- Cholanorm Cholit-ursan Delursan DESOL Destolit Deursil Dihydroxy-3.alpha.,7.alpha.(5.beta.)Cholanic acid Fluibil Gallodesoxycholic acid Hekbilin Kebilis Litursol Lyeton Paptarom Peptarom UDCA URDES Ursacol URSO URSO DS Ursobilin Ursochol Ursocholic acid, deoxy- Ursodamor Ursodeoxycholic acid Ursodesoxycholic acid Ursodiol Ursofalk Ursolvan BRN 3219888 CCRIS 2195 CCRIS 5502 EINECS 204-879-3 EINECS 207-481-8 NSC 657949 NSC 657950 NSC 683769
CAS Registry Number 474-25-9
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Formula C24H40O4
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)
InChIKey RUDATBOHQWOJDD-UHFFFAOYSA-N
Molecular Weight 392.580 g/mol
SMILES OC1CCC2(C3C(C(CC2C1)O)C1C(CC3)(C)C(CC1)C(C)CCC(O)=O)C
SPLASH splash10-0a4l-9732000000-89570dd5b45d2a29221a
Source of Spectrum HE-1982-0-0
Wiley ID 1365978