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Substance Name: 3,4,16-Triacetylcevin
RN: 24158-20-1
InChIKey: MOMZJPVPSQFETM-MFXVTZENSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C33-H49-N-O11

Molecular Weight

  • 635.746
 
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Names and Synonyms

Results Name

  • 3,4,16-Triacetylcevin

Synonyms

  • 3,4,16-Triacetylcevin
  • 4,9-Epoxycevane-3-alpha,4-beta,12,14,16-beta,17,20-heptol 3,4,16-triacetate

Systematic Name

  • Cevane-3-alpha,4-beta,12,14,16-beta,17,20-heptol, 4,9-epoxy-, 3,4,16-triacetate

Registry Numbers

CAS Registry Number

  • 24158-20-1

System Generated Number

  • 0024158201

Structure Descriptors

InChI

1S/C33H49NO11/c1-17-7-10-24-28(6,38)32(41)23(15-34(24)14-17)30(40)16-31-22(29(30,39)13-26(32)43-19(3)36)9-8-21-27(31,5)12-11-25(42-18(2)35)33(21,45-31)44-20(4)37/h17,21-26,38-41H,7-16H2,1-6H3/t17-,21?,22?,23?,24-,25+,26-,27-,28+,29+,30+,31+,32-,33-/m0/s1

InChIKey

MOMZJPVPSQFETM-MFXVTZENSA-N

Smiles

O1[C@@]23[C@@]4([C@@H](CC[C@@H]2[C@@]2(C[C@H](OC(C)=O)[C@@]5([C@@H]([C@@]2(C3)O)C[N@@]2C[C@@H](C)CC[C@@H]2[C@@]5(C)O)O)O)[C@]1([C@H](OC(C)=O)CC4)OC(C)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 150mg/kg (150mg/kg)   Pharmazie. Vol. 12, Pg. 582, 1957.