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Home › Product Catalog › [(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

[(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

CAS 61276-16-2C29H34O15MW 622.6

[(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate (CAS 61276-16-2) — formula C29H34O15, molecular weight 622.6; category organic chemicals.

Product Overview

CAS Number61276-16-2
Molecular FormulaC29H34O15
Molecular Weight622.6
LogP-0.6
CategoryOrganic Chemicals

Technical Profile

What this product is

[(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate is a carbon-based organic compound with CAS registry number 61276-16-2 and molecular formula C29H34O15 (molecular weight 622.6), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 61276-16-2

Its molecular formula C29H34O15 comprises 29 C, 34 H, 15 O atoms.

Also known as: [(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate · 黄药苷

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of [(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate?

The CAS registry number of [(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate is 61276-16-2.

What is the molecular formula and molecular weight of [(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate?

Molecular formula C29H34O15, molecular weight 622.6.

What other names is [(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate known by?

It is also registered under: [(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate, 黄药苷.

Which category does [(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for [(1R,6S,7S,8R,9R)-4-(3,4-dihydroxyphenyl)-9-(hydroxymethyl)-7-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-2,5,10-trioxabicyclo[4.4.0]dec-8-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate (CAS 61276-16-2), compiled from public chemistry databases.

Registry identifiers across databases

CAS 号61276-16-2
PubChem CID6441894
分子式C29H34O15
IUPAC 名称[(4aR,6R,7R,8S,8aS)-2-(3,4-dihydroxyphenyl)-6-(hydroxymethyl)-8-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-3,4a,6,7,8,8a-hexahydro-2H-pyrano[2,3-b][1,4]dioxin-7-yl] (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate

Computed descriptors

Molecular Weight622.6
XLogP3-0.6
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Exact Mass622.18977037
Monoisotopic Mass622.18977037
Topological Polar Surface Area234
Heavy Atom Count44

Synonyms and trade names

Oraposide; 61276-16-2; RefChem:168414; 1',2'-(3,4-Dihydroxyphenyl-alpha,beta-dioxoethanol)-4'-O-caffeoyl-O-rhamnopyranosyl-1-3-O-glucopyranoside

What the public record says

黄药苷 · CAS 61276-16-2 · C29H34O15.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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