Premithramycin A2'

Molecular Formula: C33H38O15


InChI: InChI=1/C33H38O15/c1-11(34)23-29(41)30(44-4)17-7-15-5-14-6-16(35)8-18(36)24(14)28(40)25(15)32(43)33(17,31(23)42)48-22-10-20(27(39)13(3)46-22)47-21-9-19(37)26(38)12(2)45-21/h5-6,8,12-13,17,19-22,26-27,30,35-40,42H,7,9-10H2,1-4H3/t12-,13-,17+,19-,20-,21+,22+,26+,27-,30+,33-/m1/s1

InChIKey: InChIKey=MSZWVMYMDWJNJY-JYVXNHNOBI
SMILES: CC1C(C(CC(O1)OC2CC(OC(C2O)C)OC34C(CC5=C(C3=O)C(=C6C(=C5)C=C(C=C6O)O)O)C(C(=O)C(=C4O)C(=O)C)OC)O)O

Names:
    C12385
    Premithramycin A2'
    (1S,4aR,12aS)-3-acetyl-4a-[(2S,4R,5S,6R)-4-[(2S,4R,5R,6R)-4,5-dihydroxy-6-methyl-oxan-2-yl]oxy-5-hydroxy-6-methyl-oxan-2-yl]oxy-4,6,7,9-tetrahydroxy-1-methoxy-12,12a-dihydro-1H-tetracene-2,5-dione

Registries:
    PubChem CID 443797
    PubChem ID 582775