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Structure

Herbacetin-3,8-diglucopyranoside

CAS
99224-12-1
Catalog Number
ACM99224121
Category
Other Products
Molecular Weight
626.52
Molecular Formula
C27H30O17

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Specification

Synonyms
LINOCINAMARIN;HERBACETIN, 2-N-;HERBACETIN-3,8-DIGLUCOPYRANOSIDE
What is the molecular formula of Herbacetin-3,8-diglucopyranoside?

The molecular formula of Herbacetin-3,8-diglucopyranoside is C27H30O17.

When was Herbacetin-3,8-diglucopyranoside first created in PubChem?

Herbacetin-3,8-diglucopyranoside was first created in PubChem on August 9, 2005.

What is the molecular weight of Herbacetin-3,8-diglucopyranoside?

The molecular weight of Herbacetin-3,8-diglucopyranoside is 626.5 g/mol.

What is the IUPAC name of Herbacetin-3,8-diglucopyranoside?

The IUPAC name of Herbacetin-3,8-diglucopyranoside is 5,7-dihydroxy-2-(4-hydroxyphenyl)-3,8-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one.

What is the InChI key of Herbacetin-3,8-diglucopyranoside?

The InChI key of Herbacetin-3,8-diglucopyranoside is VMOKZQAQPBUNRW-PXJYGDGDSA-N.

What is the Canonical SMILES representation of Herbacetin-3,8-diglucopyranoside?

The Canonical SMILES representation of Herbacetin-3,8-diglucopyranoside is C1=CC(=CC=C1C2=C(C(=O)C3=C(O2)C(=C(C=C3O)O)O)OC4C(C(C(C(O4)CO)O)O)O)O.

What is the CAS ID of Herbacetin-3,8-diglucopyranoside?

The CAS ID of Herbacetin-3,8-diglucopyranoside is 99224-12-1.

How many hydrogen bond donor counts are there in Herbacetin-3,8-diglucopyranoside?

There are 11 hydrogen bond donor counts in Herbacetin-3,8-diglucopyranoside.

What is the XLogP3-AA value of Herbacetin-3,8-diglucopyranoside?

The XLogP3-AA value of Herbacetin-3,8-diglucopyranoside is -1.4.

What is the topological polar surface area of Herbacetin-3,8-diglucopyranoside?

The topological polar surface area of Herbacetin-3,8-diglucopyranoside is 286 Å2.

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