| SpectraBase Compound ID | 2Qx4jYA8PW7 |
|---|---|
| InChI | InChI=1S/C32H50O5/c1-19(2)21-10-13-28(4)16-17-32(18-33)22(26(21)28)8-9-23-29(5)14-12-25(37-20(3)34)31(7,27(35)36)24(29)11-15-30(23,32)6/h21-26,33H,1,8-18H2,2-7H3,(H,35,36)/t21-,22+,23+,24+,25+,26+,28+,29+,30+,31+,32-/m0/s1 |
| InChIKey | SFMBHTKBXIQXHJ-LBIUZANVSA-N |
| Mol Weight | 514.7 g/mol |
| Molecular Formula | C32H50O5 |
| Exact Mass | 514.365825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AcvLOXY4boz |
|---|---|
| Name | 3-ALPHA-ACETOXY-27-HYDROXYLUP-20-(29)-EN-24-OIC_ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H50O5 |
| InChI | InChI=1S/C32H50O5/c1-19(2)21-10-13-28(4)16-17-32(18-33)22(26(21)28)8-9-23-29(5)14-12-25(37-20(3)34)31(7,27(35)36)24(29)11-15-30(23,32)6/h21-26,33H,1,8-18H2,2-7H3,(H,35,36)/t21-,22+,23+,24+,25+,26+,28+,29+,30+,31+,32-/m0/s1 |
| InChIKey | SFMBHTKBXIQXHJ-LBIUZANVSA-N |
| Literature Reference Author | A.U.RAHMAN,H.NAZ,X.FADIMATOU,T.MAKHMOOR,A.YASIN,N.FATIMA,F.N .NGOUNOU,S.F.KIMBU,B |
| Literature Reference Citation | J.NAT.PROD.,68,189(2005) |
| Literature Reference DOI | 10.1021/np040142x |
| Molecular Weight | 514.746 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ8869 |