CAS No.21018-84-8,AMAROGENTIN Suppliers

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Basic Information

Molecular Structure:
CAS No.:	21018-84-8
Name:	AMAROGENTIN

Formula:	C₂₉H₃₀O₁₃
Molecular Weight:	586.549
Synonyms:	Amarogentin(6CI,8CI);[1,1'-Biphenyl]-2-carboxylic acid, 3,3',5-trihydroxy-, 2-ester with5-ethenyl-6-(b-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-1H,3H-pyrano[3,4-c]pyran-1-one,[4aS-(4aa,5b,6a)]-;1H,3H-Pyrano[3,4-c]pyran-1-one,5-ethenyl-4,4a,5,6-tetrahydro-6-[[2-O-[(3,3',5-trihydroxy[1,1'-biphenyl]-2-yl)carbonyl]-b-D-glucopyranosyl]oxy]-, [4aS-(4aa,5b,6a)]-;
Density:	1.59 g/cm³
Melting Point:	229-230° (monohydrate)
Boiling Point:	928.513 °C at 760 mmHg
Flash Point:	306.944 °C
PSA:	201.67000
LogP:	1.05690

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Chemistry

Product Name: Amarogentin (CAS NO.21018-84-8)

Molecular Formula: C₂₉H₃₀O₁₃
Molecular Weight: 586.54g/mol
Mol File: 21018-84-8.mol
Melting Point: 229-230ºC
Boiling point: 928.5 °C at 760 mmHg
Flash Point: 306.9 °C
Density: 1.59 g/cm³
Surface Tension: 89.2 dyne/cm
Enthalpy of Vaporization: 141.49 kJ/mol
Structure Descriptors of Amarogentin (CAS NO.21018-84-8):
InChI : InChI=1/C29H30O13/c1-2-16-17-6-7-38-26(36)19(17)12-39-28(16)42-29-25(24(35)23(34)21(11-30)40-29)41-27(37)22-18(9-15(32)10-20(22)33)13-4-3-5-14(31)8-13/h2-5,8-10,12,16-17,21,23-25,28-35H,1,6-7,11H2/t16-,17+,21-,23-,24+,25-,28+,29+/m1/s1
Smiles: C1OC(=O)C=2[C@@H]([C@@H](C=C)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@@H]([C@H]3OC(c3c(cc(cc3c3cccc(c3)O)O)O)=O)O)OC2)C1

Specification

Amarogentin ,its CAS NO. is 21018-84-8,the synonyms is 2-(4aS-(4aalpha,5beta,6alpha))-3,3',5-Trihydroxy-(1,1'-biphenyl)-2-carboxylate ; (1,1'-Biphenyl)-2-carboxylic acid, 3,3',5-trihydroxy-, 2-ester with 5-ethenyl-6-(beta-D-glucopyranosyloxy)-4,4a,5,6-tetrahydro-1H,3H-pyrano(3,4-c)pyran-1-one, (4aS-(4aalpha,5beta,6alpha))- ; 1H,3H-Pyrano(3,4-c)pyran-1-one, 5-ethenyl-4,4a,5,6-tetrahydro-6-((2-O-((3,3',5-trihydroxy(1,1'-biphenyl)-2-yl)carbonyl)-beta-D-glucopyranosyl)oxy)-, (4aS,5R,6S)- .