5H-Benzocyclohepten-5-one, 1,8-bis[(2R,3R)-3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-3,4,6-trihydroxy- (CAS 4670-05-7) — formula C29H24O12, molecular weight 564.5; category organic chemicals.
| CAS Number | 4670-05-7 |
|---|---|
| Molecular Formula | C29H24O12 |
| Molecular Weight | 564.5 |
| LogP | 0.6 |
| Category | Organic Chemicals |
5H-Benzocyclohepten-5-one, 1,8-bis[(2R,3R)-3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-3,4,6-trihydroxy- is a carbon-based organic compound with CAS registry number 4670-05-7 and molecular formula C29H24O12 (molecular weight 564.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4670-05-7
Its molecular formula C29H24O12 comprises 29 C, 24 H, 12 O atoms.
Also known as: 5H-Benzocyclohepten-5-one, 1,8-bis[(2R,3R)-3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-3,4,6-trihydroxy- · 茶黄素
Category: organic chemicals
The CAS registry number of 5H-Benzocyclohepten-5-one, 1,8-bis[(2R,3R)-3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-3,4,6-trihydroxy- is 4670-05-7.
Molecular formula C29H24O12, molecular weight 564.5.
It is also registered under: 5H-Benzocyclohepten-5-one, 1,8-bis[(2R,3R)-3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-3,4,6-trihydroxy-, 茶黄素.
Category: Organic Chemicals.
Independent reference data for 5H-Benzocyclohepten-5-one, 1,8-bis[(2R,3R)-3,4-dihydro-3,5,7-trihydroxy-2H-1-benzopyran-2-yl]-3,4,6-trihydroxy- (CAS 4670-05-7), compiled from public chemistry databases.
| CAS 号 | 4670-05-7 |
|---|---|
| PubChem CID | 114777 |
| 分子式 | C29H24O12 |
| IUPAC 名称 | 3,4,5-trihydroxy-1,8-bis[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]benzo[7]annulen-6-one |
| Molecular Weight | 564.5 |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 9 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 2 |
| Exact Mass | 564.12677620 |
| Monoisotopic Mass | 564.12677620 |
| Topological Polar Surface Area | 218 |
| Heavy Atom Count | 41 |
C29H24O12; Theaflavin (Standard); UNII-1IA46M0D13; CHEMBL346119; orb1299669; orb3139540; GTPL12464; HY-N0243R; HY-N0243; BDBM50487716; CS-5885; AC-34090; PD132145; T7602; Q415677; 3,4,5-trihydroxy-1,8-bis[(2R,3R)-3,5,7-trihydroxychroman-2-yl]benzo[7]annulen-6-one
茶黄素 · CAS 4670-05-7 · C29H24O12.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 茶黄素