Methyl geldanamycinate
Molecular Formula:
C30H44N2O10
InChI: InChI=1/C30H44N2O10/c1-16(12-20-26(35)21(31)15-22(33)28(20)40-7)13-24(39-6)25(34)18(3)14-19(4)27(42-30(32)37)23(38-5)11-9-10-17(2)29(36)41-8/h9-11,14-16,18,23-25,27,34H,12-13,31H2,1-8H3,(H2,32,37)/b11-9+,17-10-,19-14u/f/h32H2
InChIKey: InChIKey=HRKSVRIGRTWRMY-CBFREPGLDY
SMILES: CC(CC1=C(C(=O)C=C(C1=O)N)OC)CC(C(C(C)C=C(C)C(C(C=CC=C(C)C(=O)OC)OC)OC(=O)N)O)OC
Names:
Methyl geldanamycinate
methyl (2Z,4E,8E)-15-(5-amino-2-methoxy-3,6-dioxo-1-cyclohexa-1,4-dienyl)-7-carbamoyloxy-11-hydroxy-6,12-dimethoxy-2,8,10,14-tetramethyl-pentadeca-2,4,8-trienoate
NSC212519
Registries:
PubChem CID 5458437
PubChem ID 8140626
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