| SpectraBase Compound ID | 2tB5vH817AR |
|---|---|
| InChI | InChI=1S/C30H48O5/c1-25(2)12-14-30(24(34)35)15-13-28(6)17(21(30)23(25)33)8-9-20-27(5)16-18(31)22(32)26(3,4)19(27)10-11-29(20,28)7/h8,18-23,31-33H,9-16H2,1-7H3,(H,34,35)/t18-,19?,20?,21?,22-,23+,27+,28-,29-,30+/m1/s1 |
| InChIKey | XJMYUPJDAFKICJ-HZCXZNGRSA-N |
| Mol Weight | 488.7 g/mol |
| Molecular Formula | C30H48O5 |
| Exact Mass | 488.350175 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CXnhfxVkmek |
|---|---|
| Name | 2-ALPHA,3-ALPHA,19-ALPHA-TRIHYDROXY-12-OLEANEN-28-OIC-ACID |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H48O5 |
| InChI | InChI=1S/C30H48O5/c1-25(2)12-14-30(24(34)35)15-13-28(6)17(21(30)23(25)33)8-9-20-27(5)16-18(31)22(32)26(3,4)19(27)10-11-29(20,28)7/h8,18-23,31-33H,9-16H2,1-7H3,(H,34,35)/t18-,19?,20?,21?,22-,23+,27+,28-,29-,30+/m1/s1 |
| InChIKey | XJMYUPJDAFKICJ-HZCXZNGRSA-N |
| Literature Reference Author | T.H.LEE,S.S.LEE,Y.C.KUO,C.H.CHOU |
| Literature Reference Citation | J.NAT.PROD.,64,865(2001) |
| Literature Reference DOI | 10.1021/np0100237 |
| Molecular Weight | 488.708 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI1331 |