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Substance Name: Hinoporon
RN: 101565-02-0
InChIKey: WWXLGPIPFHPOAJ-NOQYICHDSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Weight

  • 733.8935
 
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Names and Synonyms

Synonym

  • RTECS MU0434000

Systematic Name

  • Hinoporon

Registry Numbers

CAS Registry Number

  • 101565-02-0

System Generated Number

  • 0101565020

Structure Descriptors

InChI

1S/C23H32O6.C10H12O2.C9H11NO2/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3;1-7(2)8-4-3-5-9(11)10(12)6-8;1-2-12-9(11)7-3-5-8(10)6-4-7/h10,16-18,20,26,28H,4-9,11-12H2,1-3H3;3-7H,1-2H3,(H,11,12);3-6H,2,10H2,1H3/t16-,17-,18-,20+,21-,22-,23-;;/m0../s1

InChIKey

WWXLGPIPFHPOAJ-NOQYICHDSA-N

Smiles

CCOC(=O)c1ccc(cc1)N.CC(C)c1cccc(=O)c(c1)O.CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 63mg/kg (63mg/kg)   Drugs in Japan Vol. 6, Pg. 630, 1982.