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Substance Name: Destruxin D1
RN: 79385-98-1
InChIKey: XTWWITLYEHFJBO-UHFFFAOYSA-N

Molecular Formula

  • C31-H51-N5-O9

Molecular Weight

  • 637.77
 
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Names and Synonyms

Results Name

  • Destruxin D1

Synonym

  • Destruxin D1

Systematic Name

  • beta-Alanine, 4-carboxy-2-hydroxypentanoyl-2-piperidinecarbonyl-L-isoleucyl-N-methyl-L-valyl-N-methyl-L-alanyl-, (6->1)-lactone 5

Registry Numbers

CAS Registry Number

  • 79385-98-1

System Generated Number

  • 0079385981

Structure Descriptors

InChI

1S/C31H51N5O9/c1-9-18(4)24-29(41)35(8)25(17(2)3)30(42)34(7)20(6)26(38)32-14-13-23(37)45-22(16-19(5)31(43)44)28(40)36-15-11-10-12-21(36)27(39)33-24/h17-22,24-25H,9-16H2,1-8H3,(H,32,38)(H,33,39)(H,43,44)

InChIKey

XTWWITLYEHFJBO-UHFFFAOYSA-N

Smiles

C(=O)(O)[C@@H](C)C[C@@H]1C(N2[C@@H](C(N[C@@H]([C@@H](C)CC)C(=O)N(C)[C@@H](C(N([C@@H](C(NCCC(=O)O1)=O)C)C)=O)C(C)C)=O)CCCC2)=O