$65.00
| CAS No.: | 104012-37-5 |
| Molecular Formula | C₂₃H₃₄O₅ |
| Molecular Weight | 390.5g/mol |
| Purity | HPLC>98% |
| Chemical Family | Sesquiterpenoids |
| Weight |
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IUPAC Name: [(1S,3aR,5R,7S,7aS)-1-[(1R)-1-acetyloxyethyl]-4-methylidene-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydro-1H-inden-5-yl] (E)-3-methylpent-2-enoate
InChI: InChI=1S/C23H34O5/c1-8-13(4)9-21(26)28-20-11-17(12(2)3)23-18(14(20)5)10-19(25)22(23)15(6)27-16(7)24/h9,12,15,17-18,20,22-23H,5,8,10-11H2,1-4,6-7H3/b13-9+/t15-,17+,18+,20-,22+,23+/m1/s1
InChIKey: CFUPNMDNSQIWBB-UUVDBSHOSA-N
Canonical SMILES: CCC(=CC(=O)OC1CC(C2C(C1=C)CC(=O)C2C(C)OC(=O)C)C(C)C)C
Isomeric SMILES: CC/C(=C/C(=O)O[C@@H]1C[C@H]([C@H]2[C@H](C1=C)CC(=O)[C@@H]2[C@@H](C)OC(=O)C)C(C)C)/C
Synonyms: Tussilagone; 104012-37-5; UNII-95N0GBB2SX; 95N0GBB2SX; (7R,14R)-14-Acetoxy-7-((2’E)-3′-methylpent-2′-enoyloxy)-oplopanone; L-652469; 2-PENTENOIC ACID, 3-METHYL-, (1S,3AR,5R,7S,7AS)-1-((1R)-1-(ACETYLOXY)ETHYL)OCTAHYDRO-4-METHYLENE-7-(1-METHYLETHYL)-2-OXO-1H-INDEN-5-YL ESTER, (2E)-; 2-Pentenoic acid, 3-methyl-, 1-(1-(acetyloxy)ethyl)octahydro-4-methylene-7-(1-methylethyl)-2-oxo-1H-inden-5-yl ester, (1S-(1-alpha(S*),3a-beta,5-beta(E),7-alpha,7a-alpha))-; …
Botanical Source: Tussilago farfara L.
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