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Substance Name: Leucomycin V, 4(sup B),9-diacetate 3-propanoate
RN: 65178-01-0
InChIKey: YLMAKVCEJQGBBH-QECIFPIFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C42-H67-N-O16

Molecular Weight

  • 841.9823
 
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Names and Synonyms

Synonym

  • 9,4''-Diacetyl-4''-depropionylmidecamycin

Systematic Name

  • Leucomycin V, 4(sup B),9-diacetate 3-propanoate

Registry Numbers

CAS Registry Number

  • 65178-01-0

System Generated Number

  • 0065178010

Structure Descriptors

InChI

1S/C42H67NO16/c1-12-32(47)57-31-21-33(48)52-24(3)16-14-13-15-17-30(55-27(6)45)23(2)20-29(18-19-44)38(39(31)51-11)59-41-36(49)35(43(9)10)37(25(4)54-41)58-34-22-42(8,50)40(26(5)53-34)56-28(7)46/h13-15,17,19,23-26,29-31,34-41,49-50H,12,16,18,20-22H2,1-11H3/b14-13+,17-15+/t23-,24-,25-,26+,29+,30+,31-,34+,35-,36-,37-,38+,39+,40+,41+,42-/m1/s1

InChIKey

YLMAKVCEJQGBBH-QECIFPIFSA-N

Smiles

CCC(=O)O[C@@H]1CC(=O)O[C@@H](C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]1OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)OC(=O)C)(C)O)N(C)C)O)CC=O)C)OC(=O)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 5gm/kg (5000mg/kg)   Japanese Journal of Antibiotics. Vol. 37, Pg. 1488, 1984.