1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

5-[5-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-6-[[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl]oxy-6-(hydroxymethyl)-2-methyloxane-3,4-diol

2.1.2 InChI

InChI=1S/C27H48O20/c1-8-13(31)14(32)23(11(6-30)42-8)46-27-20(38)17(35)24(47-26-19(37)16(34)22(40-3)10(5-29)44-26)12(45-27)7-41-25-18(36)15(33)21(39-2)9(4-28)43-25/h8-38H,4-7H2,1-3H3

2.1.3 InChI Key

YJISHJVIRFPGGN-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)COC3C(C(C(C(O3)CO)OC)O)O)OC4C(C(C(C(O4)CO)OC)O)O)O)O)O)O

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 5-[5-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-6-[[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxymethyl]-3,4-dihydroxyoxan-2-yl]oxy-6-(hydroxymethyl)-2-methyloxane-3,4-diol

2.3 Create Date

2008-07-11

3 Chemical and Physical Properties

Molecular Formula	C₂₇H₄₈O₂₀
Molecular Weight	692.7 g/mol
XLogP3	-7.5
Hydrogen Bond Donor Count	11
Hydrogen Bond Acceptor Count	20
Rotatable Bond Count	12
Exact Mass	692.27389392 g/mol
Monoisotopic Mass	692.27389392 g/mol
Topological Polar Surface Area	306 Å²
Heavy Atom Count	47
Formal Charge	0
Complexity	950
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	20
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

Cornstarch

Cornstarch

ACCESS ALL DATA

Browse all information

CHEMISTRY

Discover Molecule Insights

ACTIVE PHARMA INGREDIENTS

8 API Suppliers

3 USDMF

4 CEP/COS

1 Listed Suppliers

$ API Reference Price

FINISHED DOSAGE FORMULATIONS

1 FDF Dossiers

1 Listed Dossiers

DIGITAL CONTENT

1 DATA COMPILATION #PharmaFlow

MARKET PLACE

2 APIs

4 EXCIPIENTS

REF. STANDARDS & IMPURITIES

2 EDQM

Filters