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Substance Name: Songorine diacetate
RN: 67806-01-3
UNII: 3W2U2H8O5F
InChIKey: UWFHTWFQCDQGKI-UQLLBUQISA-N

Classification Code

  • Natural Product

Molecular Formula

  • C26-H35-N-O5

Molecular Weight

  • 441.5645
 
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Names and Synonyms

Results Name

  • Songorine diacetate

Name of Substance

  • Songorine diacetate

Synonyms

  • 4-21-00-06539 (Beilstein Handbook Reference)
  • BRN 0063084
  • Di-O-acetylsongorine
  • Songorine diacetate
  • UNII-3W2U2H8O5F

Systematic Name

  • 7,20-Cycloveatchan-12-one, 1,5-bis(acetyloxy)-21-ethyl-4-methyl-16-methylene-, (1-alpha,15-beta)-

Registry Numbers

CAS Registry Number

  • 67806-01-3

FDA UNII

  • 3W2U2H8O5F

System Generated Number

  • 0067806013

Structure Descriptors

InChI

1S/C26H35NO5/c1-6-27-12-24(5)8-7-21(31-14(3)28)26-19(24)9-17(22(26)27)25-11-16(18(30)10-20(25)26)13(2)23(25)32-15(4)29/h16-17,19-23H,2,6-12H2,1,3-5H3/t16-,17+,19-,20-,21+,22-,23-,24+,25+,26+/m1/s1

InChIKey

UWFHTWFQCDQGKI-UQLLBUQISA-N

Smiles

CCN1C[C@]2(C)CC[C@H](OC(=O)C)[C@@]34[C@@H]2C[C@@H]([C@@H]13)[C@@]56C[C@@H](C(=O)C[C@@H]45)C(=C)[C@H]6OC(=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 802mg/kg (802mg/kg)   Journal of Ethnopharmacology. Vol. 4, Pg. 247, 1981.
mouse LD50 intravenous 132mg/kg (132mg/kg)   Journal of Ethnopharmacology. Vol. 4, Pg. 247, 1981.
mouse LD50 oral > 3gm/kg (3000mg/kg)   Journal of Ethnopharmacology. Vol. 4, Pg. 247, 1981.