8-demethyl-8-α-L-rhamnosyl-tetracenomycin C

Chemical Formula:

C₂₈H₂₈O₁₅

Molecular Weight:

604.52 Daltons

Monoisotopic Mass:

604.1428202303 Daltons

SMILES:

CC1(=C(C(=O)OC)C(=CC2(=CC3(=C(C(=C12)O)C(C4(C(=O)C=C(C(C(C3=O)4O)O)OC)O)=O)))OC5(C(O)C(C(C(C)O5)O)O))

InChI:

1S/C28H28O15/c1-8-15-10(6-12(16(8)25(37)41-4)43-26-21(33)20(32)18(30)9(2)42-26)5-11-17(19(15)31)24(36)27(38)14(29)7-13(40-3)23(35)28(27,39)22(11)34/h5-7,9,18,20-21,23,26,30-33,35,38-39H,1-4H3/t9-,18-,20+,21+,23+,26-,27+,28+/m0/s1

InChIKey:

QIJXKOOPLDVFLW-DWENXZEQSA-N

Databases

MetaCyc: CPD-16641

KEGG: C20974

ChEBI: 78283

PubChem (CID): 86289504

MetaNetX: MNXM145751