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AFLASTATIN-B

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AFLASTATIN-B
SpectraBase Compound ID 1FmZSyLlqq7
InChI InChI=1S/C61H113NO24/c1-11-12-13-14-15-16-17-18-37(63)27-61(85)59(83)58(82)56(80)46(86-61)26-45(71)55(79)57(81)54(78)44(70)24-39(65)22-38(64)23-40(66)31(5)49(73)32(6)41(67)25-42(68)33(7)50(74)34(8)51(75)35(9)52(76)43(69)21-29(3)19-28(2)20-30(4)48(72)47-53(77)36(10)62-60(47)84/h20,28-29,31-46,49-52,54-59,63-76,78-83,85H,11-19,21-27H2,1-10H3,(H,62,84)/b30-20+,48-47+
InChIKey UEBSTAVTZMKVSQ-ZQKJYTGMSA-N
Mol Weight 1244.6 g/mol
Molecular Formula C61H113NO24
Exact Mass 1243.765253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9wFD49Usm28
Name AFLASTATIN-B
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C61H113NO24
InChI InChI=1S/C61H113NO24/c1-11-12-13-14-15-16-17-18-37(63)27-61(85)59(83)58(82)56(80)46(86-61)26-45(71)55(79)57(81)54(78)44(70)24-39(65)22-38(64)23-40(66)31(5)49(73)32(6)41(67)25-42(68)33(7)50(74)34(8)51(75)35(9)52(76)43(69)21-29(3)19-28(2)20-30(4)48(72)47-53(77)36(10)62-60(47)84/h20,28-29,31-46,49-52,54-59,63-76,78-83,85H,11-19,21-27H2,1-10H3,(H,62,84)/b30-20+,48-47+
InChIKey UEBSTAVTZMKVSQ-ZQKJYTGMSA-N
Literature Reference Author M.ONO,S.SAKUDA,H.IKEDA,K.FURIHATA,J.NAKAYAMA,A.SUZUKI,A.ISOG AI
Literature Reference Citation J.ANTIBIOTICS,51,1019(1998)
Literature Reference DOI 10.7164/antibiotics.51.1019
Molecular Weight 1244.561 g/mol
Solvent DMSO-D6
Source File Reference UWKP1911