APLASMOMYCIN
Molecular Formula:
C40H60BNaO14
InChI: InChI=1/C40H60BO14.Na/c1-21-15-17-31-37(5,6)29(42)13-9-11-26-20-28(24(4)47-26)49-36(45)34-40-22(2)16-18-32(51-40)38(7,8)30(43)14-10-12-25-19-27(23(3)46-25)48-35(44)33-39(21,50-31)54-41(52-33,53-34)55-40;/h9-12,21-34,42-43H,13-20H2,1-8H3;/q-1;+1/b11-9+,12-10+;/t21-,22-,23-,24-,25-,26?,27+,28?,29-,30-,31+,32+,33?,34?,39?,40?,41?;/m1./s1
InChIKey: InChIKey=GEIYDRPAWIMINR-QLICSODIBD
SMILES: [B-]123OC4C(=O)OC5CC(C=CCC(C(C6CCC(C(O1)(O6)C(O2)C(=O)OC7CC(C=CCC(C(C8CCC(C4(O3)O8)C)(C)C)O)OC7C)C)(C)C)O)OC5C.[Na+]
Names:
APLASMOMYCIN
ICI 122,378
61230-25-9
Registries:
PubChem CID 6434608
PubChem ID 183959
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