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Substance Name: 1,2-Benzenediol, 3-(7,10-pentadecadienyl)-
RN: 68640-60-8
InChIKey: ADQRHHAWQDNVQI-HHWLVVFRSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Natural Product

Molecular Formula

  • C21-H32-O2

Molecular Weight

  • 316.4818
 
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Names and Synonyms

Synonyms

  • 3-(7,10-Pentadecadienyl)-1,2-benzenediol
  • Bhilawanol B

Systematic Name

  • 1,2-Benzenediol, 3-(7,10-pentadecadienyl)-

Registry Numbers

CAS Registry Number

  • 68640-60-8

System Generated Number

  • 0068640608

Structure Descriptors

InChI

1S/C21H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(22)21(19)23/h5-6,8-9,15,17-18,22-23H,2-4,7,10-14,16H2,1H3/b6-5+,9-8+

InChIKey

ADQRHHAWQDNVQI-HHWLVVFRSA-N

Smiles

CCCC/C=C/C/C=C/CCCCCCc1cccc(c1O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 70mg/kg (70mg/kg)   Indian Journal of Pharmaceutical Sciences. Vol. 50, Pg. 130, 1988.