[(2R,3R,4S,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxy-phenyl)ethoxy]-2 -(hydroxymethyl)-4-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2- yl]oxy-oxan-3-yl] (E)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoate (CAS 80377-39-5) — formula C31H40O15, molecular weight 652.6; category organic chemicals.
| CAS Number | 80377-39-5 |
|---|---|
| Molecular Formula | C31H40O15 |
| Molecular Weight | 652.6 |
| LogP | 0.1 |
| Category | Organic Chemicals |
[(2R,3R,4S,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxy-phenyl)ethoxy]-2 -(hydroxymethyl)-4-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2- yl]oxy-oxan-3-yl] (E)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoate is a carbon-based organic compound with CAS registry number 80377-39-5 and molecular formula C31H40O15 (molecular weight 652.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 80377-39-5
Its molecular formula C31H40O15 comprises 31 C, 40 H, 15 O atoms.
Also known as: [(2R,3R,4S,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxy-phenyl)ethoxy]-2 -(hydroxymethyl)-4-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2- yl]oxy-oxan-3-yl] (E)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoate · [(2R,3R,4S,5R,6R)-5-羟基-6-[2-(3-羟基-4-甲氧基-苯基)乙氧基]-2-(羟甲基)-4-[(2S,3R,4R,5S,6S)-3,4,5-三羟基-6-甲基-氧杂环己烷-2-基]氧基-氧杂环己烷-3-基] (E)-3-(3-羟基-4-甲氧基-苯基)丙-2-烯酸酯
Category: organic chemicals
The CAS registry number of [(2R,3R,4S,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxy-phenyl)ethoxy]-2 -(hydroxymethyl)-4-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2- yl]oxy-oxan-3-yl] (E)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoate is 80377-39-5.
Molecular formula C31H40O15, molecular weight 652.6.
It is also registered under: [(2R,3R,4S,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxy-phenyl)ethoxy]-2 -(hydroxymethyl)-4-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2- yl]oxy-oxan-3-yl] (E)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoate, [(2R,3R,4S,5R,6R)-5-羟基-6-[2-(3-羟基-4-甲氧基-苯基)乙氧基]-2-(羟甲基)-4-[(2S,3R,4R,5S,6S)-3,4,5-三羟基-6-甲基-氧杂环己烷-2-基]氧基-氧杂环己烷-3-基] (E)-3-(3-羟基-4-甲氧基-苯基)丙-2-烯酸酯.
Category: Organic Chemicals.
Independent reference data for [(2R,3R,4S,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxy-phenyl)ethoxy]-2 -(hydroxymethyl)-4-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2- yl]oxy-oxan-3-yl] (E)-3-(3-hydroxy-4-methoxy-phenyl)prop-2-enoate (CAS 80377-39-5), compiled from public chemistry databases.
| CAS 号 | 80377-39-5 |
|---|---|
| PubChem CID | 6440653 |
| 分子式 | C31H40O15 |
| IUPAC 名称 | [(2R,3R,4R,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-(hydroxymethyl)-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoate |
| Molecular Weight | 652.6 |
|---|---|
| XLogP3 | 0.1 |
| Hydrogen Bond Donor Count | 7 |
| Hydrogen Bond Acceptor Count | 15 |
| Rotatable Bond Count | 13 |
| Exact Mass | 652.23672056 |
| Monoisotopic Mass | 652.23672056 |
| Topological Polar Surface Area | 223 |
| Heavy Atom Count | 46 |
[(2R,3R,4S,5R,6R)-5-羟基-6-[2-(3-羟基-4-甲氧基-苯基)乙氧基]-2-(羟甲基)-4-[(2S,3R,4R,5S,6S)-3,4,5-三羟基-6-甲基-氧杂环己烷-2-基]氧基-氧杂环己烷-3-基] (E)-3-(3-羟基-4-甲氧基-苯基)丙-2-烯酸酯 · CAS 80377-39-5 · C31H40O15.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.