Cucurbitacin I
(8S,9R,10R,13R,14S,16R,17R)-17-[(E,2R)-2,6-dihydroxy-6-methyl-3-oxohept-4-en-2-yl]-2,16-dihydroxy-4,4,9,13,14-pentamethyl-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthrene-3,11-dione
Also Known As: Cucurbitacin I|Elatericin B|Ibamarin|Cucurbitacine (I)|Cucurbitacine I|1,2-Dehydroelatericin A|JSI-124|Cucurbitacin I (Standard)|Elatericin B (Standard)|CUCURBITACCINE (I)|2-BUTYLPHENYLHYDRAZINE|Cucurbitacin I (Elatericin B)|JSI124|EINECS 218-736-8|HY-N1405R|JSI 124|Cucurbitacin I - Bio-X trade mark|HY-N1405|TQ0196|CS-5431|Elatericin B;JSI-124;NSC-521777
| Molecular Formula | C30H42O7 |
|---|---|
| Molecular Weight | 514.293 g/mol |
| LogP | 3.6194 |
| Topological Polar Surface Area | 132.13 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 514.293 |
| Monoisotopic Mass | 514.293 |
| Heavy Atoms | 37 |
| Complexity | 1148.9154 |
Chemical Identifiers
| CAS Number | 28580-39-4 |
|---|---|
| SMILES | C[C@@]12C[C@H]([C@@H]([C@]1(CC(=O)[C@@]3([C@H]2CC=C4[C@H]3C=C(C(=O)C4(C)C)O)C)C)[C@](C)(C(=O)/C=C/C(C)(C)O)O)O |
Product Overview
Cucurbitacin I (CAS 28580-39-4), with molecular formula C30H42O7 and molecular weight 514.293 g/mol. IUPAC: (8S,9R,10R,13R,14S,16R,17R)-17-[(E,2R)-2,6-dihydroxy-6-methyl-3-oxohept-4-en-2-yl]-2,16-dihydroxy-4,4,9,13,14-pentamethyl-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthrene-3,11-dione.
Cucurbitacin I is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »