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Substance Name: Leucinostatin B
RN: 76663-52-0
InChIKey: JLDCSWRYRVBFRU-GHVJWSGMSA-N

Note

  • From Paecilomyces lilacinus A-267.

Molecular Formula

  • C61-H109-N11-O13

Molecular Weight

  • 1204.6
 
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Names and Synonyms

Name of Substance

  • Leucinostatin B

Synonym

  • Paecilotoxin B

Systematic Name

  • Leucinostatin A, 9-(N-(1-methyl-2-(methylamino)ethyl)-beta-alaninamide)-, (9(S))-

Registry Numbers

CAS Registry Number

  • 76663-52-0

System Generated Number

  • 0076663520

Structure Descriptors

InChI

1S/C61H109N11O13/c1-20-37(9)22-23-48(76)72-33-39(11)30-46(72)54(81)66-45(29-38(10)28-42(74)31-41(73)21-2)52(79)68-49(50(77)36(7)8)55(82)70-60(15,16)57(84)67-43(26-34(3)4)51(78)65-44(27-35(5)6)53(80)69-61(17,18)58(85)71-59(13,14)56(83)63-25-24-47(75)64-40(12)32-62-19/h22-23,34-40,42-46,49-50,62,74,77H,20-21,24-33H2,1-19H3,(H,63,83)(H,64,75)(H,65,78)(H,66,81)(H,67,84)(H,68,79)(H,69,80)(H,70,82)(H,71,85)/b23-22+

InChIKey

JLDCSWRYRVBFRU-GHVJWSGMSA-N

Smiles

C(NC)[C@@H](NC(CCNC(C(NC(C(NC([C@@H](NC([C@@H](NC(C(NC(=O)[C@@H](NC([C@@H](C[C@@H](C[C@@H](CC(CC)=O)O)C)NC([C@@H]1C[C@@H](CN1C(=O)\C=C\[C@@H](CC)C)C)=O)=O)[C@@H](C(C)C)O)(C)C)=O)CC(C)C)=O)CC(C)C)=O)(C)C)=O)(C)C)=O)=O)C