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Substance Name: Swalpamycin
RN: 112008-27-2
InChIKey: AAUZLHJDJNJJDM-OZLFZQAASA-N

Note

  • From Streptomyces sp. Y-84,30967.

Molecular Formula

  • C37-H56-O14

Molecular Weight

  • 724.8354
 
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Names and Synonyms

Name of Substance

  • Swalpamycin

Synonym

  • (3E,5S,6S,7S,9R,11E,13E,15R,16R)-15-(((6-Deoxy-2,3-di-O-methyl-beta-D-allopyranosyl)oxy)methyl)-6-(((4S,5R,6R,7S,9R)-6-hydroxy-4,9-dimethyl-2-oxo-1,3,8-trioxaspiro(4.5)dec-7-yl)oxy)-5,7,9,16-tetramethyloxacyclohexadeca-3,11,13-triene-2,10-dione

Systematic Name

  • Oxacyclohexadeca-3,11,13-triene-2,10-dione, 15-(((6-deoxy-2,3-di-O-methyl-beta-D-allopyranosyl)oxy)methyl)-6-(((4S,5R,6R,7S,9R)-6-hydroxy-4,9-dimethyl-2-oxo-1,3,8-trioxaspiro(4.5)dec-7-yl)oxy)-5,7,9,16-tetramethyl-, (3E,5S,6S,7S,9R,11E,13E,15R,16R)-

Registry Numbers

CAS Registry Number

  • 112008-27-2

System Generated Number

  • 0112008272

Structure Descriptors

InChI

1S/C37H56O14/c1-19-14-15-28(39)47-23(5)26(18-45-34-32(44-9)31(43-8)29(40)24(6)48-34)12-10-11-13-27(38)20(2)16-21(3)30(19)50-35-33(41)37(17-22(4)46-35)25(7)49-36(42)51-37/h10-15,19-26,29-35,40-41H,16-18H2,1-9H3/b12-10-,13-11+,15-14+/t19-,20+,21-,22+,23+,24+,25-,26+,29+,30+,31+,32+,33-,34+,35-,37?/m0/s1

InChIKey

AAUZLHJDJNJJDM-OZLFZQAASA-N

Smiles

C[C@H]1C[C@H](C(=O)/C=C/C=C\[C@@H]([C@H](OC(=O)/C=C/[C@@H]([C@H]1O[C@H]2[C@@H](C3(C[C@H](O2)C)[C@@H](OC(=O)O3)C)O)C)C)CO[C@H]4[C@@H]([C@@H]([C@@H]([C@H](O4)C)O)OC)OC)C