Cucurbitacin I (CAS 2222-07-3) — formula C30H42O7, molecular weight 514.6.
| CAS Number | 2222-07-3 |
|---|---|
| Molecular Formula | C30H42O7 |
| Molecular Weight | 514.6 |
| LogP | 2.7 |
Cucurbitacin I is a chemical compound with CAS registry number 2222-07-3 and molecular formula C30H42O7 (molecular weight 514.6).
CAS number: 2222-07-3
Its molecular formula C30H42O7 comprises 30 C, 42 H, 7 O atoms.
Also known as: Cucurbitacin I · 葫芦素I
The CAS registry number of Cucurbitacin I is 2222-07-3.
Molecular formula C30H42O7, molecular weight 514.6.
It is also registered under: Cucurbitacin I, 葫芦素I.
Independent reference data for Cucurbitacin I (CAS 2222-07-3), compiled from public chemistry databases.
| CAS Registry Number | 2222-07-3 |
|---|---|
| PubChem CID | 5281321 |
| Molecular formula | C30H42O7 |
| IUPAC name | (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 |
| UNII (FDA) | SHQ47990PH |
| Molecular Weight | 514.6 |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 514.29305367 |
| Monoisotopic Mass | 514.29305367 |
| Topological Polar Surface Area | 132 |
| Heavy Atom Count | 37 |
Cucurbitacin I; 2222-07-3; Elatericin B; JSI-124; SHQ47990PH; NSC-112167; NSC-521777; CHEBI:3947; DTXSID501015546; RefChem:579530; JSI124; DTXCID501473809; 218-736-8; 1,2-Dehydroelatericin A; Cucurbitacine (I); Cucurbitacin I (Standard)
| Reported hazard statements | H300 (50%), H301 (50%), H311 (75%) |
|---|
H300 (50%): Fatal if swallowed [Danger Acute toxicity, oral]
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
Cucurbitacin I · CAS 2222-07-3 · C30H42O7. UNII SHQ47990PH.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 葫芦素I