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Substance Name: Bottromycin C2
RN: 11027-19-3
InChIKey: IPLUEZNPBSMCTA-ISLYRVAYSA-N

Molecular Formula

  • C43-H64-N8-O7-S

Molecular Weight

  • 837.0936
 
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Names and Synonyms

  • Bottromycin C2

Registry Numbers

CAS Registry Number

  • 11027-19-3

System Generated Number

  • 0011027193

Structure Descriptors

InChI

1S/C43H64N8O7S/c1-24(2)17-18-31(52)49-37(43(8,9)10)40(56)50-34(25(3)4)42(57)51-23-26(5)27(6)36(51)38(44)46-22-32(53)48-35(28(7)29-15-13-12-14-16-29)39(55)47-30(21-33(54)58-11)41-45-19-20-59-41/h12-20,24-28,30,34-37H,21-23H2,1-11H3,(H2,44,46)(H,47,55)(H,48,53)(H,49,52)(H,50,56)/b18-17+

InChIKey

IPLUEZNPBSMCTA-ISLYRVAYSA-N

Smiles

[H]/N=C(/C1C(C(CN1C(=O)C(C(C)C)NC(=O)C(C(C)(C)C)NC(=O)/C=C/C(C)C)C)C)\NCC(=O)NC(C(C)c2ccccc2)C(=O)NC(CC(=O)OC)c3nccs3