Home > Product Catalog > All > Benzoic acid, 4-hydroxy-, [(2R,3S,4S,4aR,10bS)-2,3,4,4a,6,10b-hexahydro-3,4,8,10-tetrahydroxy-9-methoxy-6-oxopyrano[3,2-c][2]benzopyran-2-yl]methyl ester

Benzoic acid, 4-hydroxy-, [(2R,3S,4S,4aR,10bS)-2,3,4,4a,6,10b-hexahydro-3,4,8,10-tetrahydroxy-9-methoxy-6-oxopyrano[3,2-c][2]benzopyran-2-yl]methyl ester

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Catalog No. : NC25121

CAS No. : 189691-23-4

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Molecular Formula : C₂₁H₂₀O₁₁

Chemical Name : Benzoic acid, 4-hydroxy-, [(2R,3S,4S,4aR,10bS)-2,3,4,4a,6,10b-hexahydro-3,4,8,10-tetrahydroxy-9-methoxy-6-oxopyrano[3,2-c][2]benzopyran-2-yl]methyl ester

Molecular Weight : 448.38

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Basic information

Standard English name
Cas No.	189691-23-4
Alias	Benzoic acid, 4-hydroxy-, [(2R,3S,4S,4aR,10bS)-2,3,4,4a,6,10b-hexahydro-3,4,8,10-tetrahydroxy-9-methoxy-6-oxopyrano[3,2-c][2]benzopyran-2-yl]methyl ester
Canonical Smiles	COC1C(O)=C2C3OC(COC(=O)C4C=CC(O)=CC=4)C(O)C(O)C3OC(=O)C2=CC=1O
MDL No.
Exact Mass	448.10057
Smiles	O=C(OCC1OC2C3=C(O)C(OC)=C(O)C=C3C(=O)OC2C(O)C1O)C4=CC=C(O)C=C4

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Inchi	InChI=1S/C21H20O11/c1-29-17-11(23)6-10-13(15(17)25)18-19(32-21(10)28)16(26)14(24)12(31-18)7-30-20(27)8-2-4-9(22)5-3-8/h2-6,12,14,16,18-19,22-26H,7H2,1H3
InchiKey	NAWLFLCZABMDRM-UHFFFAOYSA-N
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