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Substance Name: Ulapualide B
RN: 100045-74-7
InChIKey: IRCDNHGYZIAYSJ-VYHRCCAKSA-N

Molecular Formula

  • C51-H74-N4-O16

Molecular Weight

  • 999.158
 
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Names and Synonyms

  • Ulapualide B

Registry Numbers

CAS Registry Number

  • 100045-74-7

System Generated Number

  • 0100045747

Structure Descriptors

InChI

1S/C51H74N4O16/c1-30(18-19-42(71-51(61)45(65-11)28-62-8)34(5)48(69-35(6)57)31(2)20-21-55(7)29-56)43(64-10)24-44-33(4)41(63-9)16-13-17-46-52-39(26-66-46)49-54-40(27-68-49)50-53-38(25-67-50)32(3)22-36(58)14-12-15-37(59)23-47(60)70-44/h13,17,20-21,25-27,29-34,37,41-45,48,59H,12,14-16,18-19,22-24,28H2,1-11H3/b17-13-,21-20+

InChIKey

IRCDNHGYZIAYSJ-VYHRCCAKSA-N

Smiles

c1c2nc(c3coc(n3)c3coc(n3)C=CC[C@@H]([C@@H]([C@@H](OC(=O)C[C@@H](CCCC(C[C@@H]2C)=O)O)C[C@@H](OC)[C@@H](C)CC[C@@H]([C@@H]([C@@H]([C@@H](\C=C\N(C=O)C)C)OC(C)=O)C)OC(=O)[C@@H](COC)OC)C)OC)o1