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Substance Name: Lantadene B
RN: 467-82-3
UNII: A54682CY7G
InChIKey: VYPAPFHUHDWCBI-QQAPFUPGSA-N

Note

  • From Lantana camara.

Molecular Formula

  • C35-H52-O5

Molecular Weight

  • 552.7908
 
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Names and Synonyms

Name of Substance

  • Lantadene B

Synonyms

  • 22-((3-Methyl-1-oxo-2-butenyl)oxy)-3-oxo-olean-12-en-28-oic acid, (22,beta)-
  • 3-10-00-04397 (Beilstein Handbook Reference)
  • BRN 3078144
  • HSDB 3504
  • Lantadene B
  • Olean-12-en-28-oic acid, 22-((3-methyl-1-oxo-2-butenyl)oxy)-3-oxo-, (22beta)-
  • Olean-12-en-28-oic acid, 22-beta-hydroxy-3-oxo-, 3-methylcrotonate
  • UNII-A54682CY7G

Systematic Name

  • Olean-12-en-28-oic acid, 22-beta-hydroxy-3-oxo-, 3-methylcrotonate

Registry Numbers

CAS Registry Number

  • 467-82-3

FDA UNII

  • A54682CY7G

System Generated Number

  • 0000467823

Structure Descriptors

InChI

1S/C35H52O5/c1-21(2)18-28(37)40-27-20-30(3,4)19-23-22-10-11-25-32(7)14-13-26(36)31(5,6)24(32)12-15-34(25,9)33(22,8)16-17-35(23,27)29(38)39/h10,18,23-25,27H,11-17,19-20H2,1-9H3,(H,38,39)/t23-,24-,25+,27+,32-,33+,34+,35-/m0/s1

InChIKey

VYPAPFHUHDWCBI-QQAPFUPGSA-N

Smiles

[C@]12([C@H](C3=CC[C@H]4[C@]([C@@]3(CC2)C)(CC[C@@H]2[C@@]4(CCC(=O)C2(C)C)C)C)CC(C[C@H]1OC(=O)/C=C(\C)C)(C)C)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
domestic animals - goat/sheep LDLo oral 300mg/kg (300mg/kg) BEHAVIORAL: FOOD INTAKE (ANIMAL)

LIVER: "JAUNDICE, OTHER OR UNCLASSIFIED"

GASTROINTESTINAL: DECREASED MOTILITY OR CONSTIPATION
Australian Veterinary Journal. Vol. 53, Pg. 230, 1977.