| SpectraBase Compound ID | G5pwNfzp7eF |
|---|---|
| InChI | InChI=1S/C24H38O6/c1-12(4-7-19(27)28)14-5-6-15-20-16(11-18(26)24(14,15)3)23(2)9-8-13(25)10-17(23)21(29)22(20)30/h4,7,12-18,20-22,25-26,29-30H,5-6,8-11H2,1-3H3,(H,27,28)/b7-4+/t12-,13-,14-,15+,16+,17+,18+,20+,21-,22+,23-,24-/m1/s1 |
| InChIKey | QHDBYORLMWCMGO-CGNNNINVSA-N |
| Mol Weight | 422.6 g/mol |
| Molecular Formula | C24H38O6 |
| Exact Mass | 422.266839 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CKGOIKh7luZ |
|---|---|
| Name | (22E)-3-ALPHA,6-ALPHA,7-ALPHA,12-ALPHA-TETRAHYDROXY-5-BETA-CHOL-22-EN-24-OIC-ACID |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H38O6 |
| InChI | InChI=1S/C24H38O6/c1-12(4-7-19(27)28)14-5-6-15-20-16(11-18(26)24(14,15)3)23(2)9-8-13(25)10-17(23)21(29)22(20)30/h4,7,12-18,20-22,25-26,29-30H,5-6,8-11H2,1-3H3,(H,27,28)/b7-4+/t12-,13-,14-,15+,16+,17+,18+,20+,21-,22+,23-,24-/m1/s1 |
| InChIKey | QHDBYORLMWCMGO-CGNNNINVSA-N |
| Literature Reference Author | S.OGAWA,Y.ADACHI,G.KAKIYAMA,M.SHIMADA,N.MANO,,J.GOTO,T.IIDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,58,1103(2010) |
| Literature Reference DOI | 10.1248/cpb.58.1103 |
| Molecular Weight | 422.562 g/mol |
| Source File Reference | UWBT3741 |