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Tenuifoliside B - 97%, high purity , CAS No.139726-36-6

    Grade & Purity:
  • ≥97%
In stock
Item Number
T664641
Grouped product items
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Availability
Price Qty
T664641-10mg
10mg
Available within 8-12 weeks(?)
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$666.90

Basic Description

Specifications & Purity ≥97%
Storage Temp Room temperature
Shipped In Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Phenylpropanoids and polyketides
Class Cinnamic acids and derivatives
Subclass Hydroxycinnamic acids and derivatives
Intermediate Tree Nodes Not available
Direct Parent Coumaric acids and derivatives
Alternative Parents Cinnamic acid esters  p-Hydroxybenzoic acid alkyl esters  C-glycosyl compounds  Disaccharides  O-glycosyl compounds  Dimethoxybenzenes  Methoxyphenols  Styrenes  Anisoles  Benzoyl derivatives  Phenoxy compounds  1-hydroxy-2-unsubstituted benzenoids  Alkyl aryl ethers  Fatty acid esters  Ketals  Oxanes  Dicarboxylic acids and derivatives  Enoate esters  Oxolanes  Secondary alcohols  Oxacyclic compounds  Polyols  Carbonyl compounds  Hydrocarbon derivatives  Primary alcohols  Organic oxides  
Molecular Framework Aromatic heteromonocyclic compounds
Substituents Coumaric acid or derivatives - Cinnamic acid ester - P-hydroxybenzoic acid alkyl ester - P-hydroxybenzoic acid ester - C-glycosyl compound - Disaccharide - Glycosyl compound - O-glycosyl compound - Benzoate ester - Methoxyphenol - M-dimethoxybenzene - Dimethoxybenzene - Benzoic acid or derivatives - Anisole - Phenoxy compound - Benzoyl - Methoxybenzene - Phenol ether - Styrene - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Ketal - Phenol - Fatty acid ester - Benzenoid - Fatty acyl - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Oxane - Oxolane - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Secondary alcohol - Carboxylic acid ester - Organoheterocyclic compound - Acetal - Oxacycle - Ether - Carboxylic acid derivative - Polyol - Hydrocarbon derivative - Alcohol - Primary alcohol - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description This compound belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring.
External Descriptors Not available

Names and Identifiers

IUPAC Name [(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[(2S,3S,4R,5R)-4-hydroxy-3-[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxyoxan-2-yl]methyl 4-hydroxybenzoate
INCHI InChI=1S/C30H36O17/c1-41-17-9-14(10-18(42-2)22(17)35)3-8-21(34)45-27-24(37)19(11-31)46-30(27,13-32)47-29-26(39)25(38)23(36)20(44-29)12-43-28(40)15-4-6-16(33)7-5-15/h3-10,19-20,23-27,29,31-33,35-39H,11-13H2,1-2H3/b8-3+/t19-,20-,23-,24-,25+,26-,27+,29-,30+/m1/s1
InChIKey HBYKIOIUVMDUIK-GUJRDUPISA-N
Smiles COC1=CC(=CC(=C1O)OC)C=CC(=O)OC2C(C(OC2(CO)OC3C(C(C(C(O3)COC(=O)C4=CC=C(C=C4)O)O)O)O)CO)O
Isomeric SMILES COC1=CC(=CC(=C1O)OC)/C=C/C(=O)O[C@H]2[C@@H]([C@H](O[C@@]2(CO)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COC(=O)C4=CC=C(C=C4)O)O)O)O)CO)O
Alternate CAS 139726-36-6
PubChem CID 10055215
Molecular Weight 668.6

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Molecular Weight 668.600 g/mol
XLogP3 -0.900
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 17
Rotatable Bond Count 14
Exact Mass 668.195 Da
Monoisotopic Mass 668.195 Da
Topological Polar Surface Area 261.000 Ų
Heavy Atom Count 47
Formal Charge 0
Complexity 1040.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 9
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 1
Covalently-Bonded Unit Count 1

Solution Calculators

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