7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one

C18H14O4 — CID 102343711

IUPAC7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one
SMILESCOc1ccc2c(c1)COc1ccc(OC)cc1-c1c-2c1=O
InChIInChI=1S/C18H14O4/c1-20-11-3-5-13-10(7-11)9-22-15-6-4-12(21-2)8-14(15)17-16(13)18(17)19/h3-8H,9H2,1-2H3
InChIKeyFCVLQUHEOFOTJZ-UHFFFAOYSA-N
MW294.31 g/mol
LogP3.17
Rot. Bonds2

About 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one

7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one (PubChem CID 102343711) has the molecular formula C18H14O4 and a molecular weight of 294.31 g/mol. Its IUPAC name is 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one.

Molecular Properties

Compound Name7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one
PubChem CID102343711
Molecular FormulaC18H14O4
Molecular Weight294.31 g/mol
Exact Mass294.09
IUPAC Name7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one
SMILESCOc1ccc2c(c1)COc1ccc(OC)cc1-c1c-2c1=O
InChIInChI=1S/C18H14O4/c1-20-11-3-5-13-10(7-11)9-22-15-6-4-12(21-2)8-14(15)17-16(13)18(17)19/h3-8H,9H2,1-2H3
InChIKeyFCVLQUHEOFOTJZ-UHFFFAOYSA-N
XLogP3.17
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methoxy-6H-benzo[c]chromene
CID 10798586
6-methoxy-1-benzofuran-3-one
CID 585368
(3E)-6-methoxy-3-[(4-methoxyphenyl)methylidene]chromen-4-one
CID 6449188
2-bromo-8-methoxy-6H-isochromeno[3,4-c]pyridine
CID 134324079
6-methoxy-1H-benzo[f][2]benzofuran-3-one
CID 132515747
3,6-dimethoxy-10H-anthracen-9-one
CID 142018270
(E,4E)-4-(2-methoxy-6H-benzo[c][1]benzoxepin-11-ylidene)but-2-enoic acid
CID 139839434
5-methoxy-1-benzofuran-2,3-dione
CID 153138791
3-[(4-ethoxyphenyl)methylidene]-6-methoxychromen-4-one
CID 74618182
(3E)-6-methoxy-3-[(4-methylsulfanylphenyl)methylidene]chromen-4-one
CID 24662432
(3E)-3-[(4-ethoxyphenyl)methylidene]-6-methoxychromen-4-one
CID 31762948
(3Z)-7-methoxy-3-[(4-methoxyphenyl)methylidene]chromen-4-one
CID 6444482

Frequently Asked Questions

What is the IUPAC name of 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one?
The IUPAC name of 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one (CID 102343711) is 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one.
What is the SMILES notation for 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one?
The canonical SMILES for 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one is COc1ccc2c(c1)COc1ccc(OC)cc1-c1c-2c1=O.
What is the InChIKey of 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one?
The InChIKey is FCVLQUHEOFOTJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14O4/c1-20-11-3-5-13-10(7-11)9-22-15-6-4-12(21-2)8-14(15)17-16(13)18(17)19/h3-8H,9H2,1-2H3.
What are the key properties of 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one?
7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one has a molecular weight of 294.31 g/mol, XLogP of 3.17, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,15-dimethoxy-11-oxatetracyclo[11.4.0.02,4.05,10]heptadeca-1(13),2(4),5(10),6,8,14,16-heptaen-3-one is sourced from PubChem (CID 102343711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).