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Substance Name: Ostodin
RN: 85527-84-0
InChIKey: ONRXYRNHXFYAGT-ZLMSCERHSA-N

Molecular Formula

  • C33-H46-O10

Molecular Weight

  • 602.7164
 
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Names and Synonyms

Name of Substance

  • Ostodin

Synonyms

  • (+)-Ostodin
  • delta-5,6-7-Hydroperoxy-12-O-undecadienoylphorbol-13-acetate
  • NSC 353862

Systematic Name

  • Undecadienoic acid, 9a-(acetyloxy)-1a,1b,2,4a,5,7a,7b,8,9,9a-decahydro-2-hydroperoxy-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1H-cyclopropa(3,4)benz(1,2-e)azulen-9-yl ester, (1aR-(1aalpha,1bbeta,2beta,4abeta,7aalpha,7balpha,8alpha,9beta,9aalpha))-

Registry Numbers

CAS Registry Number

  • 85527-84-0

System Generated Number

  • 0085527840

Structure Descriptors

InChI

1S/C33H46O10/c1-7-8-9-10-11-12-13-14-15-24(36)41-29-20(3)32(39)23-16-19(2)28(37)31(23,38)17-22(18-34)26(43-40)25(32)27-30(5,6)33(27,29)42-21(4)35/h12-17,20,23,25-27,29,34,38-40H,7-11,18H2,1-6H3/b13-12+,15-14+/t20-,23-,25+,26+,27-,29-,31-,32+,33-/m1/s1

InChIKey

ONRXYRNHXFYAGT-ZLMSCERHSA-N

Smiles

CCCCCC/C=C/C=C/C(=O)O[C@@H]1[C@H]([C@@]2([C@@H]3C=C(C(=O)[C@]3(C=C([C@@H]([C@H]2[C@H]4[C@@]1(C4(C)C)OC(=O)C)OO)CO)O)C)O)C