BGC > Product Search > 3,4-Isochlorogenic acid B | 14534-61-3

Molecular Formula: C25H24O12
Molecular Weight: 516.45
WGKGermany: 3
HS Code: 29189900

Description :
Isochlorogenic acid B is a reference substance of a common phytochemical found in Echinacea (Echinacea sp.). It has antiviral activity and shows activity against respiratory syncyntial virus (RSV).

• Molecular Weight :516.45
• Boiling Point :810.8±65.0 °C | Condition: Press: 760 Torr
• Purity :> 98%

Molecular Formula :
C25H24O12
Canonical SMILES :
C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O
InChI :
1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)/b7-3+,8-4+/t19-,20-,23-,25+/m1/s1
InChIKey :
UFCLZKMFXSILNL-PSEXTPKNSA-N
Solubility :
Soluble in DMSO
Appearance :
White powder
Storage : Store in a cool and dry place and at 0 - 4℃ for short term (days to weeks) or -67℃ for long term (months to years).
Synonyms :
(1S,3R,4R,5R)-3,4-Bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid;3,4-Dicaffeoylquinic acid;(1S)-1α,5α-Dihydroxy-3β,4α-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1β-cyclohexanecarboxylic acid;(1S)-4β,5α

More details are to be found here

Description :
Isochlorogenic acid B is a reference substance of a common phytochemical found in Echinacea (Echinacea sp.). It has antiviral activity and shows activity against respiratory syncyntial virus (RSV).

• Molecular Weight :516.45
• Boiling Point :810.8±65.0 °C | Condition: Press: 760 Torr
• Purity :> 98%

Molecular Formula :
C25H24O12
Canonical SMILES :
C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)OC(=O)C=CC3=CC(=C(C=C3)O)O)O
InChI :
1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(35,24(33)34)11-19(30)23(20)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,35H,11-12H2,(H,33,34)/b7-3+,8-4+/t19-,20-,23-,25+/m1/s1
InChIKey :
UFCLZKMFXSILNL-PSEXTPKNSA-N
Solubility :
Soluble in DMSO
Appearance :
White powder
Storage : Store in a cool and dry place and at 0 - 4℃ for short term (days to weeks) or -67℃ for long term (months to years).
Synonyms :
(1S,3R,4R,5R)-3,4-Bis[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy]-1,5-dihydroxycyclohexane-1-carboxylic acid;3,4-Dicaffeoylquinic acid;(1S)-1α,5α-Dihydroxy-3β,4α-bis[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1β-cyclohexanecarboxylic acid;(1S)-4β,5α

More details are to be found here