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Substance Name: Stevastelin A
RN: 147334-91-6
InChIKey: ZYBIPFWMMJVRNL-KYKYUHFBSA-N

Note

  • A depsipeptide from Penicillium.

Molecular Formula

  • C34-H61-N3-O12-S

Molecular Weight

  • 735.9309
 
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Names and Synonyms

Name of Substance

  • Stevastelin A

Systematic Name

  • NK 374186A

Registry Numbers

CAS Registry Number

  • 147334-91-6

System Generated Number

  • 0147334916

Structure Descriptors

InChI

1S/C34H61N3O12S/c1-8-9-10-11-12-13-14-15-16-17-18-19-28(40)23(4)31(41)24(5)32(42)36-30(22(2)3)34(44)37(27(20-38)21-48-50(45,46)47)33(43)29(35)25(6)49-26(7)39/h12-13,20,22-25,27-31,40-41H,8-11,14-19,21,35H2,1-7H3,(H,36,42)(H,45,46,47)/b13-12+/t23-,24-,25-,27-,28-,29+,30+,31-/m1/s1

InChIKey

ZYBIPFWMMJVRNL-KYKYUHFBSA-N

Smiles

CCCCC/C=C/CCCCCC[C@H]([C@@H](C)[C@H]([C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N([C@@H](COS(=O)(=O)O)C=O)C(=O)[C@H]([C@@H](C)OC(=O)C)N)O)O