| SpectraBase Compound ID | 9blxud9MwRL |
|---|---|
| InChI | InChI=1S/C30H46O5/c1-16-8-11-30(25(34)35)13-12-28(6)18(22(30)17(16)2)14-19(31)23-27(5)15-20(32)24(33)26(3,4)21(27)9-10-29(23,28)7/h14,16-17,20-24,32-33H,8-13,15H2,1-7H3,(H,34,35)/t16-,17+,20-,21?,22+,23?,24+,27+,28-,29-,30+/m1/s1 |
| InChIKey | LOGACJITTVIXDN-XSJGXZOFSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C30H46O5 |
| Exact Mass | 486.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | dhQUCgwvuz |
|---|---|
| Name | 2-ALPHA,3-BETA-DIHYDROXY-URS-12-EN-11-ON-28-OIC-ACID;TERNSTROEMIC-ACID |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O5 |
| InChI | InChI=1S/C30H46O5/c1-16-8-11-30(25(34)35)13-12-28(6)18(22(30)17(16)2)14-19(31)23-27(5)15-20(32)24(33)26(3,4)21(27)9-10-29(23,28)7/h14,16-17,20-24,32-33H,8-13,15H2,1-7H3,(H,34,35)/t16-,17+,20-,21?,22+,23?,24+,27+,28-,29-,30+/m1/s1 |
| InChIKey | LOGACJITTVIXDN-XSJGXZOFSA-N |
| Literature Reference Author | A.IKUTA,H.TOMIYASU,Y.MORITA,K.YOSHIMURA |
| Literature Reference Citation | J.NAT.PROD.,66,1051(2003) |
| Literature Reference DOI | 10.1021/np030069v |
| Molecular Weight | 486.692 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSP140 |