potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide

C65H89KO16 — CID 159276488

IUPACpotassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide
SMILESC=C(C)C(CC=C(C)C)Cc1c(OCOC)cc(OC)c(C(=O)/C=C/c2ccc(OCOC)cc2OCOC)c1C.C=C(C)C(CC=C(C)C)Cc1c(OCOC)cc(OC)c(C(C)=O)c1C.COCOc1cc(C)ccc1C=O.[K+].[OH-]
InChIInChI=1S/C33H44O8.C22H32O4.C10H12O3.K.H2O/c1-22(2)10-11-26(23(3)4)16-28-24(5)33(32(38-9)18-31(28)41-21-37-8)29(34)15-13-25-12-14-27(39-19-35-6)17-30(25)40-20-36-7;1-14(2)9-10-18(15(3)4)11-19-16(5)22(17(6)23)21(25-8)12-20(19)26-13-24-7;1-8-3-4-9(6-11)10(5-8)13-7-12-2;;/h10,12-15,17-18,26H,3,11,16,19-21H2,1-2,4-9H3;9,12,18H,3,10-11,13H2,1-2,4-8H3;3-6H,7H2,1-2H3;;1H2/q;;;+1;/p-1/b15-13+;;;;
InChIKeyKYJGOXBBGVNLFJ-RNUMPHLQSA-M
MW1165.51 g/mol
LogP10.84
Rot. Bonds32

About potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide

potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide (PubChem CID 159276488) has the molecular formula C65H89KO16 and a molecular weight of 1165.51 g/mol. Its IUPAC name is potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide.

Molecular Properties

Compound Namepotassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide
PubChem CID159276488
Molecular FormulaC65H89KO16
Molecular Weight1165.51 g/mol
Exact Mass1164.58
IUPAC Namepotassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide
SMILESC=C(C)C(CC=C(C)C)Cc1c(OCOC)cc(OC)c(C(=O)/C=C/c2ccc(OCOC)cc2OCOC)c1C.C=C(C)C(CC=C(C)C)Cc1c(OCOC)cc(OC)c(C(C)=O)c1C.COCOc1cc(C)ccc1C=O.[K+].[OH-]
InChIInChI=1S/C33H44O8.C22H32O4.C10H12O3.K.H2O/c1-22(2)10-11-26(23(3)4)16-28-24(5)33(32(38-9)18-31(28)41-21-37-8)29(34)15-13-25-12-14-27(39-19-35-6)17-30(25)40-20-36-7;1-14(2)9-10-18(15(3)4)11-19-16(5)22(17(6)23)21(25-8)12-20(19)26-13-24-7;1-8-3-4-9(6-11)10(5-8)13-7-12-2;;/h10,12-15,17-18,26H,3,11,16,19-21H2,1-2,4-9H3;9,12,18H,3,10-11,13H2,1-2,4-8H3;3-6H,7H2,1-2H3;;1H2/q;;;+1;/p-1/b15-13+;;;;
InChIKeyKYJGOXBBGVNLFJ-RNUMPHLQSA-M
XLogP10.84
TPSA191.97 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds32
Heavy Atoms82
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001165.51
LogP ≤ 510.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide with MolForge

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Frequently Asked Questions

What is the IUPAC name of potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide?
The IUPAC name of potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide (CID 159276488) is potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide.
What is the SMILES notation for potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide?
The canonical SMILES for potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide is C=C(C)C(CC=C(C)C)Cc1c(OCOC)cc(OC)c(C(=O)/C=C/c2ccc(OCOC)cc2OCOC)c1C.C=C(C)C(CC=C(C)C)Cc1c(OCOC)cc(OC)c(C(C)=O)c1C.COCOc1cc(C)ccc1C=O.[K+].[OH-].
What is the InChIKey of potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide?
The InChIKey is KYJGOXBBGVNLFJ-RNUMPHLQSA-M. The full InChI is InChI=1S/C33H44O8.C22H32O4.C10H12O3.K.H2O/c1-22(2)10-11-26(23(3)4)16-28-24(5)33(32(38-9)18-31(28)41-21-37-8)29(34)15-13-25-12-14-27(39-19-35-6)17-30(25)40-20-36-7;1-14(2)9-10-18(15(3)4)11-19-16(5)22(17(6)23)21(25-8)12-20(19)26-13-24-7;1-8-3-4-9(6-11)10(5-8)13-7-12-2;;/h10,12-15,17-18,26H,3,11,16,19-21H2,1-2,4-9H3;9,12,18H,3,10-11,13H2,1-2,4-8H3;3-6H,7H2,1-2H3;;1H2/q;;;+1;/p-1/b15-13+;;;;.
What are the key properties of potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide?
potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide has a molecular weight of 1165.51 g/mol, XLogP of 10.84, 32 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;(E)-3-[2,4-bis(methoxymethoxy)phenyl]-1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]prop-2-en-1-one;1-[6-methoxy-4-(methoxymethoxy)-2-methyl-3-(5-methyl-2-prop-1-en-2-ylhex-4-enyl)phenyl]ethanone;2-(methoxymethoxy)-4-methylbenzaldehyde;hydroxide is sourced from PubChem (CID 159276488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).