(3S)-6α-Acetyloxy-1,2,3,6,7,7a,10,14,14aβ,14b-decahydro-3,13-dimethoxy-5,5,7aβ,9,14bα-pentamethyl-12H-3β,5aβ-epoxy-5H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one (CAS 81543-01-3) — formula C28H36O9, molecular weight 516.6; category organic chemicals.
| CAS Number | 81543-01-3 |
|---|---|
| Molecular Formula | C28H36O9 |
| Molecular Weight | 516.6 |
| LogP | 3.3 |
| Category | Organic Chemicals |
(3S)-6α-Acetyloxy-1,2,3,6,7,7a,10,14,14aβ,14b-decahydro-3,13-dimethoxy-5,5,7aβ,9,14bα-pentamethyl-12H-3β,5aβ-epoxy-5H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one is a carbon-based organic compound with CAS registry number 81543-01-3 and molecular formula C28H36O9 (molecular weight 516.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 81543-01-3
Its molecular formula C28H36O9 comprises 28 C, 36 H, 9 O atoms.
Also known as: (3S)-6α-Acetyloxy-1,2,3,6,7,7a,10,14,14aβ,14b-decahydro-3,13-dimethoxy-5,5,7aβ,9,14bα-pentamethyl-12H-3β,5aβ-epoxy-5H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one · (3S)-6α-乙酰氧基-1,2,3,6,7,7a,10,14,14aβ,14b-十氢-3,13-二甲氧基-5,5,7aβ,9,14bα-五甲基-12H-3β,5aβ-环氧-5H-呋喃[3,4-i]oxepino[4,3-a]xanthen-12-one
Category: organic chemicals
The CAS registry number of (3S)-6α-Acetyloxy-1,2,3,6,7,7a,10,14,14aβ,14b-decahydro-3,13-dimethoxy-5,5,7aβ,9,14bα-pentamethyl-12H-3β,5aβ-epoxy-5H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one is 81543-01-3.
Molecular formula C28H36O9, molecular weight 516.6.
It is also registered under: (3S)-6α-Acetyloxy-1,2,3,6,7,7a,10,14,14aβ,14b-decahydro-3,13-dimethoxy-5,5,7aβ,9,14bα-pentamethyl-12H-3β,5aβ-epoxy-5H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one, (3S)-6α-乙酰氧基-1,2,3,6,7,7a,10,14,14aβ,14b-十氢-3,13-二甲氧基-5,5,7aβ,9,14bα-五甲基-12H-3β,5aβ-环氧-5H-呋喃[3,4-i]oxepino[4,3-a]xanthen-12-one.
Category: Organic Chemicals.
Independent reference data for (3S)-6α-Acetyloxy-1,2,3,6,7,7a,10,14,14aβ,14b-decahydro-3,13-dimethoxy-5,5,7aβ,9,14bα-pentamethyl-12H-3β,5aβ-epoxy-5H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one (CAS 81543-01-3), compiled from public chemistry databases.
| CAS 号 | 81543-01-3 |
|---|---|
| PubChem CID | 157977 |
| 分子式 | C28H36O9 |
| IUPAC 名称 | [(1R,2R,4S,16R,17R,20S)-13,20-dimethoxy-4,7,17,22,22-pentamethyl-11-oxo-5,10,21,23-tetraoxahexacyclo[18.2.1.01,17.04,16.06,14.08,12]tricosa-6(14),7,12-trien-2-yl] acetate |
| Molecular Weight | 516.6 |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 516.23593272 |
| Monoisotopic Mass | 516.23593272 |
| Topological Polar Surface Area | 98.8 |
| Heavy Atom Count | 37 |
Austalide A; 81543-01-3; RefChem:1050329; CHEBI:224141; DTXSID201002047; NCGC00384842-01
(3S)-6α-乙酰氧基-1,2,3,6,7,7a,10,14,14aβ,14b-十氢-3,13-二甲氧基-5,5,7aβ,9,14bα-五甲基-12H-3β,5aβ-环氧-5H-呋喃[3,4-i]oxepino[4,3-a]xanthen-12-one · CAS 81543-01-3 · C28H36O9.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.