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Substance Name: Verucopeptin
RN: 138067-14-8
UNII: 2XJ0D6E0XC
InChIKey: IKTLLLGZSOKVRF-GWALSTOSSA-N

Note

  • Isolated from Actinomadura verrucosospora; 19-membered cyclodepsipeptide.

Molecular Weight

  • 896.0857
 
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Names and Synonyms

Name of Substance

  • Verucopeptin

Synonym

  • UNII-2XJ0D6E0XC

Systematic Name

  • Glycine, 3-hydroxy-N-(2-hydroxy-1-oxo-2-(tetrahydro-2-hydroxy-5-methoxy-6-(1,3,5,7-tetramethyl-1-nonenyl)-2H-pyran-2-yl)propyl)leucylhexahydro-3-pyridazinecarbonyl-N-hydroxyglycyl-N-methylglycylglycyl-N-methyl-, rho-lactone

Registry Numbers

CAS Registry Number

  • 138067-14-8

FDA UNII

  • 2XJ0D6E0XC

System Generated Number

  • 0138067148

Structure Descriptors

InChI

1S/C43H73N7O13/c1-12-26(4)18-27(5)19-28(6)20-29(7)38-31(61-11)15-16-43(59,63-38)42(8,58)41(57)46-36-37(25(2)3)62-35(54)24-48(10)33(52)21-44-32(51)22-47(9)34(53)23-49(60)39(55)30-14-13-17-45-50(30)40(36)56/h20,25-28,30-31,36-38,45,58-60H,12-19,21-24H2,1-11H3,(H,44,51)(H,46,57)/b29-20+/t26-,27+,28+,30-,31+,36+,37+,38-,42-,43?/m1/s1

InChIKey

IKTLLLGZSOKVRF-GWALSTOSSA-N

Smiles

CC[C@@H](C)C[C@H](C)C[C@H](C)\C=C(/C)\[C@H]1OC(O)(CC[C@@H]1OC)[C@](C)(O)C(=O)N[C@H]2[C@@H](OC(=O)CN(C)C(=O)CNC(=O)CN(C)C(=O)CN(O)C(=O)[C@H]3CCCNN3C2=O)C(C)C