Chemical Properties of 3-Caffeoyl quinic acid, TMS

3-Caffeoyl quinic acid, TMS

PDF Excel Molecule Calculator
InChI
InChI=1S/C34H66O9Si6/c1-44(2,3)38-27-21-19-26(23-28(27)39-45(4,5)6)20-22-31(35)37-29-24-34(43-49(16,17)18,33(36)42-48(13,14)15)25-30(40-46(7,8)9)32(29)41-47(10,11)12/h19-23,29-30,32H,24-25H2,1-18H3/b22-20+/t29-,30-,32+,34-/m0/s1
InChI Key
ZUMPKHAQJVFOSF-XDUBOXGASA-N
Formula
C34H66O9Si6
SMILES
C[Si](C)(C)OC(=O)C1(O[Si](C)(C)C)CC(OC(=O)C=Cc2ccc(O[Si](C)(C)C)c(O[Si](C)(C)C)c2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1
Molecular Weight1
787.40
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Physical Properties

Property Value Unit Source
log10WS 3.78 Crippen Calculated Property
logPoct/wat 9.241 Crippen Calculated Property
Inp [3113.70; 3113.70]   Show Hide
Inp 3113.70 NIST
Inp 3113.70 NIST

Similar Compounds

trans-5-O-Caffeoyl-D-quinic acid, hexakis-TMS. Caffeoylquinic acid, TMS. Chlorogenic acid (6TMS). Caffeoylquinic acid, 5-trans-, 6TMS. Caffeoylquinic acid, 3-trans-, 6TMS. trans-3-O-Caffeoyl-D-quinic acid, hexakis-TMS. 5-O-Feruloylquinic acid, 5TMS. cis-5-O-Feruloylquinic acid, 5TMS. 3-O-Feruloylquinic acid, 5TMS. Caffeoylquinic acid, 4-trans-, 6TMS. trans-4-O-Caffeoyl-D-quinic acid, hexakis-TMS. 4-O-Feruloylquinic acid, 5TMS. 5-Caffeoyl quinic acid, TMS. 3-O-Coumaroyl-D-quinic acid, 5TMS. trans-3-O-Coumaroyl-D-quinic acid, pentakis-TMS.

Find more compounds similar to 3-Caffeoyl quinic acid, TMS.

Sources

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