CID 25135909

C19H12O4 — CID 25135909

IUPAC—
SMILESO=C1C=CC2(C1)C(=O)C=CC21Oc2cccc3cccc(c23)O1
InChIInChI=1S/C19H12O4/c20-13-7-9-18(11-13)16(21)8-10-19(18)22-14-5-1-3-12-4-2-6-15(23-19)17(12)14/h1-10H,11H2
InChIKeyFUGWWCKAKCDXRZ-UHFFFAOYSA-N
MW304.30 g/mol
LogP2.96
Rot. Bonds

About CID 25135909

CID 25135909 (PubChem CID 25135909) has the molecular formula C19H12O4 and a molecular weight of 304.30 g/mol.

Molecular Properties

Compound NameCID 25135909
PubChem CID25135909
Molecular FormulaC19H12O4
Molecular Weight304.30 g/mol
Exact Mass304.07
IUPAC Name—
SMILESO=C1C=CC2(C1)C(=O)C=CC21Oc2cccc3cccc(c23)O1
InChIInChI=1S/C19H12O4/c20-13-7-9-18(11-13)16(21)8-10-19(18)22-14-5-1-3-12-4-2-6-15(23-19)17(12)14/h1-10H,11H2
InChIKeyFUGWWCKAKCDXRZ-UHFFFAOYSA-N
XLogP2.96
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.30
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(1R,6S,7R,10S)-7,10-dihydroxyspiro[11-oxatricyclo[4.4.1.01,6]undeca-3,8-diene-5,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-2-one
CID 51693578
CID 25135916
CID 25135916
CID 25137533
CID 25137533
(1R,2R,5R,6R,7S)-spiro[11-oxatricyclo[4.4.1.01,6]undec-8-ene-10,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-2,5,7-triol
CID 38356079
spiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,5'-3,4-dihydro-2H-naphthalene]-1',8'-dione
CID 11186201
(1S)-3,7,10-trihydroxyspiro[11-oxatricyclo[4.4.1.01,6]undeca-3,8-diene-5,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-2-one
CID 163775433
(1S,2S,5R,6S,7S)-spiro[11-oxatricyclo[4.4.1.01,6]undeca-3,8-diene-10,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-2,5,7-triol
CID 124893147
(4'R,4'aS,8'S,8'aR)-4',8'-dihydroxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,5'-4,4a,8,8a-tetrahydronaphthalene]-1'-one
CID 139583207
(4'S,4'aS,8'R,8'aR)-4',8'-dihydroxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,5'-4,4a,8,8a-tetrahydronaphthalene]-1'-one
CID 163065359
(1R,5S,7S,8S,9R)-5,7,8,9-tetrahydroxyspiro[11-oxatricyclo[4.4.1.01,6]undec-3-ene-10,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-2-one
CID 162974907
(1'S,2'S,3'S,5'S,7'R)-2'-hydroxy-2'-methoxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,6'-4,12-dioxatetracyclo[5.4.1.01,7.03,5]dodec-9-ene]-8',11'-dione
CID 162920945
8'-methoxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,4'-naphthalene]-1'-one
CID 10925545

Frequently Asked Questions

What is the IUPAC name of CID 25135909?
The IUPAC name of CID 25135909 (CID 25135909) is not available.
What is the SMILES notation for CID 25135909?
The canonical SMILES for CID 25135909 is O=C1C=CC2(C1)C(=O)C=CC21Oc2cccc3cccc(c23)O1.
What is the InChIKey of CID 25135909?
The InChIKey is FUGWWCKAKCDXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12O4/c20-13-7-9-18(11-13)16(21)8-10-19(18)22-14-5-1-3-12-4-2-6-15(23-19)17(12)14/h1-10H,11H2.
What are the key properties of CID 25135909?
CID 25135909 has a molecular weight of 304.30 g/mol, XLogP of 2.96, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 25135909 is sourced from PubChem (CID 25135909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).