Mrv1572004191602092D          

 24 29  0  0  0  0            999 V2000
    5.4154   -1.1401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7496   -1.6272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6349   -0.9811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0808   -1.5924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1266    2.0930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3265   -0.3199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9948   -1.2941    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3825   -0.1957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7256   -1.4183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5766    1.4781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9341    1.9241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4828    0.8334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7281    1.1665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4853   -0.6279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5717    0.0132    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9059   -0.4739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4239   -0.0215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9779   -0.6328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0622    0.6794    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8341    0.6943    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1916    1.1403    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1511   -0.1408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7305   -0.2948    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6416    0.5254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  4  3  2  0  0  0  0
  6  1  1  0  0  0  0
  7  2  1  0  0  0  0
  8  3  1  0  0  0  0
  9  4  1  0  0  0  0
 10  5  2  0  0  0  0
 11  5  1  0  0  0  0
 13 12  2  0  0  0  0
 15  6  2  0  0  0  0
 15 12  1  0  0  0  0
 16  7  2  0  0  0  0
 16 15  1  0  0  0  0
 17  8  2  0  0  0  0
 18  9  2  0  0  0  0
 18 17  1  0  0  0  0
 19 13  1  0  0  0  0
 20 10  1  0  0  0  0
 20 17  1  0  0  0  0
 21 11  2  0  0  0  0
 21 19  1  0  0  0  0
 22 14  1  0  0  0  0
 22 16  1  0  0  0  0
 22 19  2  0  0  0  0
 23 14  2  0  0  0  0
 23 18  1  0  0  0  0
 24 20  2  0  0  0  0
 24 21  1  0  0  0  0
 24 23  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM007928

> <DATABASE_NAME>
chemdb

> <SMILES>
C1=CC=C2C(=C1)C1=CC3=C(C=CC4=CC=CC=C34)C3=CC=CC2=C13

> <INCHI_IDENTIFIER>
InChI=1S/C24H14/c1-2-7-16-15(6-1)12-13-19-21-11-5-10-20-17-8-3-4-9-18(17)23(24(20)21)14-22(16)19/h1-14H

> <INCHI_KEY>
LFGDHICYJIULAO-UHFFFAOYSA-N

> <FORMULA>
C24H14

> <MOLECULAR_WEIGHT>
302.376

> <EXACT_MASS>
302.109550451

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_ATOM_COUNT>
38

> <JCHEM_AVERAGE_POLARIZABILITY>
35.65779150727709

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
hexacyclo[11.10.1.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁹.0²⁰,²⁴]tetracosa-1(23),2(11),3,5,7,9,12,14,16,18,20(24),21-dodecaene

> <ALOGPS_LOGP>
7.16

> <JCHEM_LOGP>
6.2628809940000005

> <ALOGPS_LOGS>
-8.72

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0.0

> <JCHEM_REFRACTIVITY>
99.62299999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
5.76e-07 g/l

> <JCHEM_TRADITIONAL_IUPAC>
hexacyclo[11.10.1.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁹.0²⁰,²⁴]tetracosa-1(23),2(11),3,5,7,9,12,14,16,18,20(24),21-dodecaene

> <JCHEM_VEBER_RULE>
1

> <NAME>
Naphtho(1,2-b)fluoranthene

> <CAS>
111189-32-3

> <SYNONYMS>
Naphtho[1,2-<i>b</i>]fluoranthene

$$$$