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Substance Name: Propanamide, N-(7,13-bis(acetyloxy)-1,4,10,19-tetramethyl-17,18-dioxo-16-oxabicyclo(13.2.2)nonadeca-3,5,9,11-tetraen-2-yl)-, diacetate (ester) (all-E-(1S,2R,7S,13S,15R,19R)-
RN: 23498-38-6
InChIKey: ZFELIRXUSWRMPY-DEGHCPDGSA-N

Molecular Formula

  • C29-H37-N-O9

Molecular Weight

  • 543.609
 
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Names and Synonyms

Synonyms

  • Lankacidin C 8,14-diacetate
  • Lankacidin C diacetate

Systematic Names

  • Propanamide, N-(7,13-bis(acetyloxy)-1,4,10,19-tetramethyl-17,18-dioxo-16-oxabicyclo(13.2.2)nonadeca-3,5,9,11-tetraen-2-yl)-, diacetate (ester) (all-E-(1S,2R,7S,13S,15R,19R)-
  • Propanamide, N-(7,13-bis(acetyloxy)-1,4,10,19-tetramethyl-17,18-dioxo-16-oxabicyclo(13.2.2)nonadeca-3,5,9,11-tetraen-2-yl)-2-oxo-, (1S-(1R*,2S*,3E,5E,7R*,9E,11E,13R*,15S*,19S*))-

Registry Numbers

CAS Registry Number

  • 23498-38-6

System Generated Number

  • 0023498386

Structure Descriptors

InChI

1S/C29H37NO9/c1-16-8-11-22(37-20(5)32)12-10-17(2)14-25(30-27(35)19(4)31)29(7)26(34)18(3)24(39-28(29)36)15-23(13-9-16)38-21(6)33/h8-10,12-14,18,22-25H,11,15H2,1-7H3,(H,30,35)/b12-10-,13-9-,16-8-,17-14-/t18-,22+,23-,24-,25-,29+/m1/s1

InChIKey

ZFELIRXUSWRMPY-DEGHCPDGSA-N

Smiles

C(C(C)=O)(=O)N[C@H]1[C@@]2(C(O[C@H](C[C@@H](C=CC(=CC[C@@H](C=CC(=C1)C)OC(=O)C)C)OC(=O)C)[C@H](C2=O)C)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 5gm/kg (5000mg/kg)   Journal of Antibiotics. Vol. 26, Pg. 647, 1973.