Lactoquinomycin B

5-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-4-hydroxy-17-methyl-12,16,18-trioxapentacyclo[8.7.1.01,10.03,8.011,15]octadeca-3(8),4,6-triene-2,9,13-trione

Also Known As: Lactoquinomycin B|5-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-4-hydroxy-17-methyl-12,16,18-trioxapentacyclo[8.7.1.01,10.03,8.011,15]octadeca-3(8),4,6-triene-2,9,13-trione|5a,11a-Epoxy-5H-furo(3,2-b)naphtho(2,3-d)pyran-2,6,11(3H)-trione, 3a,11b-dihydro-7-hydroxy-5-methyl-8-(2,3,6-trideoxy-3-(dimethylamino)-beta-arabino-hexopyranosyl)-|1,5-Anhydro-2,3,6-trideoxy-3-(dimethylamino)-1-(7-hydroxy-5-methyl-2,6,11-trioxo-2,3,3a,6,11,11b-hexahydro-5H-5a,11a-epoxyfuro[3,2-b]naphtho[2,3-d]pyran-8-yl)hexitol|3a,11b-Dihydro-7-hydroxy-5-methyl-8-[2,3,6-trideoxy-3-(dimethylamino)-beta-D-arabino-hexopyranosyl]-5a,11a-epoxy-5H-furo[3,2-b]naphtho[2,3-d]pyran-2,6,11(3H)-trione|5-(4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl)-4-hydroxy-17-methyl-12,16,18-trioxapentacyclo(8.7.1.01,10.03,8.011,15)octadeca-3(8),4,6-triene-2,9,13-trione

Molecular Formula	C24H27NO9
Molecular Weight	473.16858 g/mol
LogP	0.4
Topological Polar Surface Area	135.0 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	10
Rotatable Bonds	2
Exact Mass	473.16858
Monoisotopic Mass	473.16858
Heavy Atoms	34
Complexity	939.0

Chemical Identifiers

CAS Number	101342-94-3
SMILES	CC1C(C(CC(O1)C2=C(C3=C(C=C2)C(=O)C45C6C(CC(=O)O6)OC(C4(C3=O)O5)C)O)N(C)C)O
InChIKey	UKGUMAYTBDAONQ-UHFFFAOYSA-N