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Substance Name: 6-Hepten-4-yn-3-ol, 1-((3-methylbutyl)thio)-2,3,6-trimethyl-
RN: 102244-18-8
InChIKey: XRBMDVUHHPMDEZ-UHFFFAOYSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C15-H26-O-S
Molecular Weight
- 254.435
Names and Synonyms
Synonyms
- 1-((3-Methylbutyl)thio)-2,3,6-trimethyl-6-hepten-4-yn-3-ol
- 2,5,6-Trimethyl-7-isopentylthiohept-1-en-3-yn-5-ol
- BRN 5511702
Systematic Name
- 6-Hepten-4-yn-3-ol, 1-((3-methylbutyl)thio)-2,3,6-trimethyl-
Registry Numbers
CAS Registry Number
- 102244-18-8
System Generated Number
- 0102244188
Structure Descriptors
InChI
1S/C15H26OS/c1-12(2)7-9-15(6,16)14(5)11-17-10-8-13(3)4/h13-14,16H,1,8,10-11H2,2-6H3InChIKey
XRBMDVUHHPMDEZ-UHFFFAOYSA-NSmiles
C([C@@]([C@@H](CSCCC(C)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 550mg/kg (550mg/kg) | Pharmaceutical Chemistry Journal Vol. 20, Pg. 89, 1986. |