[2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid

C106H142O58 — CID 161367590

IUPAC[2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid
SMILESC=C(C)C(=O)OCC(O)COC(=O)/C=C\C(=O)OC.C=C(C)C(=O)OCC(O)COC(=O)/C=C\C(=O)OC1COC2C(C)COC12.C=C(C)C(=O)OCC(O)COC1COC2C(O)COC12.C=C(C)C(=O)OCC(O)COC1COC2C(OCC(O)COC(=O)C(=C)C)COC12.C=CC(=O)OCC(O)COC(=O)/C=C\C(=O)OC.C=CC(=O)OCC(O)COC(=O)/C=C\C(=O)OC1COC2C(C)COC12.CC(=O)/C=C\C(=O)OC1COC2C(OC(=O)/C=C\C(=O)O)COC12
InChIInChI=1S/C20H30O10.C18H24O9.C17H22O9.C15H16O9.C13H20O7.C12H16O7.C11H14O7/c1-11(2)19(23)29-7-13(21)5-25-15-9-27-18-16(10-28-17(15)18)26-6-14(22)8-30-20(24)12(3)4;1-10(2)18(22)26-8-12(19)7-23-14(20)4-5-15(21)27-13-9-25-16-11(3)6-24-17(13)16;1-3-13(19)22-7-11(18)8-23-14(20)4-5-15(21)26-12-9-25-16-10(2)6-24-17(12)16;1-8(16)2-4-12(19)23-9-6-21-15-10(7-22-14(9)15)24-13(20)5-3-11(17)18;1-7(2)13(16)20-4-8(14)3-17-10-6-19-11-9(15)5-18-12(10)11;1-8(2)12(16)19-7-9(13)6-18-11(15)5-4-10(14)17-3;1-3-9(13)17-6-8(12)7-18-11(15)5-4-10(14)16-2/h13-18,21-22H,1,3,5-10H2,2,4H3;4-5,11-13,16-17,19H,1,6-9H2,2-3H3;3-5,10-12,16-18H,1,6-9H2,2H3;2-5,9-10,14-15H,6-7H2,1H3,(H,17,18);8-12,14-15H,1,3-6H2,2H3;4-5,9,13H,1,6-7H2,2-3H3;3-5,8,12H,1,6-7H2,2H3/b;2*5-4-;4-2-,5-3-;;2*5-4-
InChIKeyVQADYAXSVGLIPD-XYZYBQNHSA-N
MW2344.24 g/mol
LogP-3.56
Rot. Bonds54

About [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid

[2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid (PubChem CID 161367590) has the molecular formula C106H142O58 and a molecular weight of 2344.24 g/mol. Its IUPAC name is [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid.

Molecular Properties

Compound Name[2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid
PubChem CID161367590
Molecular FormulaC106H142O58
Molecular Weight2344.24 g/mol
Exact Mass2342.82
IUPAC Name[2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid
SMILESC=C(C)C(=O)OCC(O)COC(=O)/C=C\C(=O)OC.C=C(C)C(=O)OCC(O)COC(=O)/C=C\C(=O)OC1COC2C(C)COC12.C=C(C)C(=O)OCC(O)COC1COC2C(O)COC12.C=C(C)C(=O)OCC(O)COC1COC2C(OCC(O)COC(=O)C(=C)C)COC12.C=CC(=O)OCC(O)COC(=O)/C=C\C(=O)OC.C=CC(=O)OCC(O)COC(=O)/C=C\C(=O)OC1COC2C(C)COC12.CC(=O)/C=C\C(=O)OC1COC2C(OC(=O)/C=C\C(=O)O)COC12
InChIInChI=1S/C20H30O10.C18H24O9.C17H22O9.C15H16O9.C13H20O7.C12H16O7.C11H14O7/c1-11(2)19(23)29-7-13(21)5-25-15-9-27-18-16(10-28-17(15)18)26-6-14(22)8-30-20(24)12(3)4;1-10(2)18(22)26-8-12(19)7-23-14(20)4-5-15(21)27-13-9-25-16-11(3)6-24-17(13)16;1-3-13(19)22-7-11(18)8-23-14(20)4-5-15(21)26-12-9-25-16-10(2)6-24-17(12)16;1-8(16)2-4-12(19)23-9-6-21-15-10(7-22-14(9)15)24-13(20)5-3-11(17)18;1-7(2)13(16)20-4-8(14)3-17-10-6-19-11-9(15)5-18-12(10)11;1-8(2)12(16)19-7-9(13)6-18-11(15)5-4-10(14)17-3;1-3-9(13)17-6-8(12)7-18-11(15)5-4-10(14)16-2/h13-18,21-22H,1,3,5-10H2,2,4H3;4-5,11-13,16-17,19H,1,6-9H2,2-3H3;3-5,10-12,16-18H,1,6-9H2,2H3;2-5,9-10,14-15H,6-7H2,1H3,(H,17,18);8-12,14-15H,1,3-6H2,2H3;4-5,9,13H,1,6-7H2,2-3H3;3-5,8,12H,1,6-7H2,2H3/b;2*5-4-;4-2-,5-3-;;2*5-4-
InChIKeyVQADYAXSVGLIPD-XYZYBQNHSA-N
XLogP-3.56
TPSA783.30 Ų
H-Bond Donors9
H-Bond Acceptors57
Rotatable Bonds54
Heavy Atoms164
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002344.24
LogP ≤ 5-3.56
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1057

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid?
The IUPAC name of [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid (CID 161367590) is [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid.
What is the SMILES notation for [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid?
The canonical SMILES for [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid is C=C(C)C(=O)OCC(O)COC(=O)/C=C\C(=O)OC.C=C(C)C(=O)OCC(O)COC(=O)/C=C\C(=O)OC1COC2C(C)COC12.C=C(C)C(=O)OCC(O)COC1COC2C(O)COC12.C=C(C)C(=O)OCC(O)COC1COC2C(OCC(O)COC(=O)C(=C)C)COC12.C=CC(=O)OCC(O)COC(=O)/C=C\C(=O)OC.C=CC(=O)OCC(O)COC(=O)/C=C\C(=O)OC1COC2C(C)COC12.CC(=O)/C=C\C(=O)OC1COC2C(OC(=O)/C=C\C(=O)O)COC12.
What is the InChIKey of [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid?
The InChIKey is VQADYAXSVGLIPD-XYZYBQNHSA-N. The full InChI is InChI=1S/C20H30O10.C18H24O9.C17H22O9.C15H16O9.C13H20O7.C12H16O7.C11H14O7/c1-11(2)19(23)29-7-13(21)5-25-15-9-27-18-16(10-28-17(15)18)26-6-14(22)8-30-20(24)12(3)4;1-10(2)18(22)26-8-12(19)7-23-14(20)4-5-15(21)27-13-9-25-16-11(3)6-24-17(13)16;1-3-13(19)22-7-11(18)8-23-14(20)4-5-15(21)26-12-9-25-16-10(2)6-24-17(12)16;1-8(16)2-4-12(19)23-9-6-21-15-10(7-22-14(9)15)24-13(20)5-3-11(17)18;1-7(2)13(16)20-4-8(14)3-17-10-6-19-11-9(15)5-18-12(10)11;1-8(2)12(16)19-7-9(13)6-18-11(15)5-4-10(14)17-3;1-3-9(13)17-6-8(12)7-18-11(15)5-4-10(14)16-2/h13-18,21-22H,1,3,5-10H2,2,4H3;4-5,11-13,16-17,19H,1,6-9H2,2-3H3;3-5,10-12,16-18H,1,6-9H2,2H3;2-5,9-10,14-15H,6-7H2,1H3,(H,17,18);8-12,14-15H,1,3-6H2,2H3;4-5,9,13H,1,6-7H2,2-3H3;3-5,8,12H,1,6-7H2,2H3/b;2*5-4-;4-2-,5-3-;;2*5-4-.
What are the key properties of [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid?
[2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid has a molecular weight of 2344.24 g/mol, XLogP of -3.56, 54 rotatable bonds, 9 hydrogen bond donors, and 57 hydrogen bond acceptors.
Where does this data come from?
All data for [2-hydroxy-3-[(3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl)oxy]propyl] 2-methylprop-2-enoate;[2-hydroxy-3-[[6-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propoxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl]oxy]propyl] 2-methylprop-2-enoate;1-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-[2-hydroxy-3-(2-methylprop-2-enoyloxy)propyl] 1-O-methyl (Z)-but-2-enedioate;1-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 4-O-(3-methyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl) (Z)-but-2-enedioate;4-O-(2-hydroxy-3-prop-2-enoyloxypropyl) 1-O-methyl (Z)-but-2-enedioate;(Z)-4-oxo-4-[[3-[(Z)-4-oxopent-2-enoyl]oxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl]oxy]but-2-enoic acid is sourced from PubChem (CID 161367590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).