(4R,5R)-benzo[a]pyrene-trans-4,5-dihydrodiol
Chemical Formula:
C20H14O2
Molecular Weight:
286.329 Daltons
Monoisotopic Mass:
286.0993796936 Daltons
SMILES:
C5(C=CC1(=C(C=C2(C(O)C(O)C3(C=CC=C4(C=CC1=C2C=34))))C=5))
InChI:
1S/C20H14O2/c21-19-15-7-3-5-11-8-9-14-13-6-2-1-4-12(13)10-16(20(19)22)18(14)17(11)15/h1-10,19-22H/t19-,20-/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-20310
PubChem (CID):
37785