8,9-Dihydro-6,12,13-trihydroxy-3,3-dimethyl-5-(3-methyl-2-butenyl)-9-(1-methylethylidene)-3H,7H-pyrano[2',3':7,8][1]benzopyrano[3,2-d][1]benzoxepin-7-one (CAS 49794-94-7) — formula C30H30O7, molecular weight 502.6; category organic chemicals.
| CAS Number | 49794-94-7 |
|---|---|
| Molecular Formula | C30H30O7 |
| Molecular Weight | 502.6 |
| Melting Point | 231 °C |
| LogP | 6.9 |
| Category | Organic Chemicals |
8,9-Dihydro-6,12,13-trihydroxy-3,3-dimethyl-5-(3-methyl-2-butenyl)-9-(1-methylethylidene)-3H,7H-pyrano[2',3':7,8][1]benzopyrano[3,2-d][1]benzoxepin-7-one is a carbon-based organic compound with CAS registry number 49794-94-7 and molecular formula C30H30O7 (molecular weight 502.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 49794-94-7
Its molecular formula C30H30O7 comprises 30 C, 30 H, 7 O atoms.
Also known as: 8,9-Dihydro-6,12,13-trihydroxy-3,3-dimethyl-5-(3-methyl-2-butenyl)-9-(1-methylethylidene)-3H,7H-pyrano[2',3':7,8][1]benzopyrano[3,2-d][1]benzoxepin-7-one · 8,9-二氢-6,12,13-三羟基-3,3-二甲基-5-(3-甲基-2-丁烯基)-9-(1-甲基亚乙基)-3H,7H-吡喃并[2',3':7,8][1]苯并吡喃并[3,2-d][1]苯并氧杂环庚烷-7-酮
Category: organic chemicals
The CAS registry number of 8,9-Dihydro-6,12,13-trihydroxy-3,3-dimethyl-5-(3-methyl-2-butenyl)-9-(1-methylethylidene)-3H,7H-pyrano[2',3':7,8][1]benzopyrano[3,2-d][1]benzoxepin-7-one is 49794-94-7.
Molecular formula C30H30O7, molecular weight 502.6.
It is also registered under: 8,9-Dihydro-6,12,13-trihydroxy-3,3-dimethyl-5-(3-methyl-2-butenyl)-9-(1-methylethylidene)-3H,7H-pyrano[2',3':7,8][1]benzopyrano[3,2-d][1]benzoxepin-7-one, 8,9-二氢-6,12,13-三羟基-3,3-二甲基-5-(3-甲基-2-丁烯基)-9-(1-甲基亚乙基)-3H,7H-吡喃并[2',3':7,8][1]苯并吡喃并[3,2-d][1]苯并氧杂环庚烷-7-酮.
Category: Organic Chemicals.
Independent reference data for 8,9-Dihydro-6,12,13-trihydroxy-3,3-dimethyl-5-(3-methyl-2-butenyl)-9-(1-methylethylidene)-3H,7H-pyrano[2',3':7,8][1]benzopyrano[3,2-d][1]benzoxepin-7-one (CAS 49794-94-7), compiled from public chemistry databases.
| CAS 号 | 49794-94-7 |
|---|---|
| PubChem CID | 71437947 |
| 分子式 | C30H30O7 |
| IUPAC 名称 | 11,20,21-trihydroxy-7,7-dimethyl-10-(3-methylbut-2-enyl)-16-propan-2-ylidene-2,8,17-trioxapentacyclo[12.9.0.03,12.04,9.018,23]tricosa-1(14),3,5,9,11,18,20,22-octaen-13-one |
| UNII（FDA） | ALL6767AYE |
| Molecular Weight | 502.6 |
|---|---|
| XLogP3 | 6.9 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 2 |
| Exact Mass | 502.19915329 |
| Monoisotopic Mass | 502.19915329 |
| Topological Polar Surface Area | 105 |
| Heavy Atom Count | 37 |
| Melting Point | 231 °C |
|---|
49794-94-7; RefChem:311569; Isocycloheterophyllin; ALL6767AYE; CHEBI:175843; DTXSID501099891
8,9-二氢-6,12,13-三羟基-3,3-二甲基-5-(3-甲基-2-丁烯基)-9-(1-甲基亚乙基)-3H,7H-吡喃并[2',3':7,8][1]苯并吡喃并[3,2-d][1]苯并氧杂环庚烷-7-酮 · CAS 49794-94-7 · C30H30O7. UNII ALL6767AYE. Melting Point: 231 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.