Urdamycin A pentaacetate
Molecular Formula:
C53H68O22
InChI: InChI=1/C51H64O21.C2H4O/c1-22-33(66-26(5)52)13-15-40(64-22)72-51-38(56)20-49(9,60)21-50(51,61)17-16-32-43(51)46(59)31-11-10-30(44(57)42(31)45(32)58)35-18-36(47(24(3)62-35)68-28(7)54)71-39-14-12-34(23(2)63-39)70-41-19-37(67-27(6)53)48(25(4)65-41)69-29(8)55;1-2-3/h10-11,16-17,22-25,33-37,39-41,47-48,57,60-61H,12-15,18-21H2,1-9H3;2H,1H3/t22u,23u,24u,25u,33?,34?,35u,36?,37?,39?,40?,41?,47?,48?,49-,50?,51?;/m1./s1
InChIKey: InChIKey=AAAHAJYGUJOUBH-JZGVQUGBBD
SMILES: CC=O.CC1C(CCC(O1)OC2CC(OC(C2OC(=O)C)C)C3=C(C4=C(C=C3)C(=O)C5=C(C4=O)C=CC6(C5(C(=O)CC(C6)(C)O)OC7CCC(C(O7)C)OC(=O)C)O)O)OC8CC(C(C(O8)C)OC(=O)C)OC(=O)C
Names:
NSC613244
Urdamycin A pentaacetate
Registries:
PubChem CID 5459094
PubChem ID 8141994
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