7-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-9-ethanoyl-9-methyl-6,11-bis(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride

Systemtic Name: 7-(4-azanyl-6-methyl-5-oxidanyl-oxan-2-yl)oxy-9-ethanoyl-9-methyl-6,11-bis(oxidanyl)-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride Openeye Name: 9-acetyl-7-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-6,11-dihydroxy-9-methyl-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride CAS Name: 9-acetyl-7-[(4-amino-5-hydroxy-6-methyl-2-oxanyl)oxy]-6,11-dihydroxy-9-methyl-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride IUPAC Name: 9-acetyl-7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,11-dihydroxy-9-methyl-8,10-dihydro-7H-tetracene-5,12-dione hydrochloride Traditional Name: 9-acetyl-7-(4-amino-5-hydroxy-6-methyl-tetrahydropyran-2-yl)oxy-6,11-dihydroxy-9-methyl-8,10-dihydro-7H-tetracene-5,12-quinone hydrochloride Formula: C27H30ClNO8 MolecularWeight: 531.982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=CC=CC=C5C4=O)O)(C)C(=O)C)N)O.Cl

Isomeric SMILES

CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=CC=CC=C5C4=O)O)(C)C(=O)C)N)O.Cl

InChI

InChI=1S/C27H29NO8.ClH/c1-11-22(30)16(28)8-18(35-11)36-17-10-27(3,12(2)29)9-15-19(17)26(34)21-20(25(15)33)23(31)13-6-4-5-7-14(13)24(21)32;/h4-7,11,16-18,22,30,33-34H,8-10,28H2,1-3H3;1H