| SpectraBase Compound ID | 3v7AkLkLP7S |
|---|---|
| InChI | InChI=1S/C24H40O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-21,25-26H,4-13H2,1-3H3,(H,27,28) |
| InChIKey | DGABKXLVXPYZII-UHFFFAOYSA-N |
| Mol Weight | 392.6 g/mol |
| Molecular Formula | C24H40O4 |
| Exact Mass | 392.29266 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AnRpaSHbNx6 |
|---|---|
| Name | Cholan-24-oic acid, 3,6-dihydroxy-, (3.alpha.,5.beta.,6.alpha.)- |
| CAS Registry Number | 83-49-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H40O4 |
| InChI | InChI=1S/C24H40O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-21,25-26H,4-13H2,1-3H3,(H,27,28) |
| InChIKey | DGABKXLVXPYZII-UHFFFAOYSA-N |
| Molecular Weight | 392.580 g/mol |
| SMILES | OC(CCC(C1CCC2C1(CCC1C2CC(C2CC(CCC12C)O)O)C)C)=O |
| SPLASH | splash10-052f-9521000000-dac156aa6c8a9c17042a |
| Source of Spectrum | NP-18-9613-0 |
| Synonyms | 3,6-Dihydroxycholan-24-oic acid .alpha.-Hyodeoxycholic acid 3-.alpha.,6-.alpha.-Dihydroxy-5-.beta.-cholan-24-oic acid 4-(3,6-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-(3,6-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-3,6-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.-Cholanic acid-3-.alpha.,6-.alpha.-diol 5.beta.-Cholan-24-oic acid, 3.alpha.,6.alpha.-dihydroxy- 6-.alpha.-Hydroxylithocholic acid 7-Deoxyhyocholic acid Cholan-24-oic acid, 3,6-dihydroxy-, (3alpha,5beta,6alpha)- Hyodeoxycholic acid Hyodesoxycholic acid Hyodesoxycholsaeure BRN 3218394 EINECS 201-483-2 NSC 60672 |
| Wiley ID | 1111645 |