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Substance Name: Strospeside
RN: 595-21-1
InChIKey: CPFNIKYEDJFRAT-RVPZLBNISA-N

Classification Code

  • Natural Product

Molecular Formula

  • C30-H46-O9

Molecular Weight

  • 550.6844
 
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Names and Synonyms

Name of Substance

  • Strospeside

Synonyms

  • Desgluco-digitalinum verum
  • Desgluco-digitalinum verum [German]
  • EINECS 209-859-8
  • Gitoxigenin 3-O-monodigitaloside
  • Gitoxogenin-D-digitalosid
  • Gitoxogenin-D-digitalosid [German]
  • Strospesid
  • Strospesid [German]
  • Strospeside

Systematic Names

  • (3beta,5beta,16beta)-3-((6-Deoxy-3-O-methyl-D-galactopyranosyl)oxy)-14,16-dihydroxycard-20(22)-enolide
  • 5-beta-Card-20(22)-enolide, 3-beta-((6-deoxy-3-O-methyl-D-galactopyranosyl)oxy)-14,16-dihydroxy-

Registry Numbers

CAS Registry Number

  • 595-21-1

System Generated Number

  • 0000595211

Structure Descriptors

InChI

1S/C30H46O9/c1-15-24(33)26(36-4)25(34)27(38-15)39-18-7-9-28(2)17(12-18)5-6-20-19(28)8-10-29(3)23(16-11-22(32)37-14-16)21(31)13-30(20,29)35/h11,15,17-21,23-27,31,33-35H,5-10,12-14H2,1-4H3/t15-,17-,18+,19+,20-,21+,23+,24+,25-,26+,27+,28+,29-,30+/m1/s1

InChIKey

CPFNIKYEDJFRAT-RVPZLBNISA-N

Smiles

C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)O)O)C)C)O)OC)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LD50 intravenous 410ug/kg (0.41mg/kg)   "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963Vol. -, Pg. 194, 1963.
cat LDLo unreported 407ug/kg (0.407mg/kg)   "Die Herzwirksamen Glykoside," Baumgarten, G., and W. Forster, Leipzig, Ger. Dem. Rep., VEB Georg Thieme, 1963Vol. -, Pg. 123, 1963.
dog LDLo intravenous 530ug/kg (0.53mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 165, Pg. 343, 1967.
frog LD50 intravenous 750ug/kg (0.75mg/kg)   Nippon Yakurigaku Zasshi. Japanese Journal of Pharmacology. Vol. 61, Pg. 231, 1965.
guinea pig LDLo intravenous 1990ug/kg (1.99mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

CARDIAC: OTHER CHANGES

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 436, 1965.
mouse LD50 oral 41200ug/kg (41.2mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

CARDIAC: OTHER CHANGES

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 436, 1965.
mouse LD50 subcutaneous 40mg/kg (40mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

CARDIAC: OTHER CHANGES
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 153, Pg. 436, 1965.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.59 (none)   EXP
Water Solubility 106 mg/L 25 EST
Vapor Pressure 9.84E-21 mm Hg 25 EST
Henry's Law Constant 9.81E-19 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.32E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.