Structure

Tutin

CAS
2571-22-4
Catalog Number
ACM2571224
Category
Main Products
Molecular Weight
294.30
Molecular Formula
C15H18O6

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Specification

Synonyms
Tutu; Toot poison;
IUPAC Name
Tutin
Canonical SMILES
CC(=C)C1C2C(C3(C4(CO4)C5C(C3(C1C(=O)O2)O)O5)C)O
InChI Key
CCAZWUJBLXKBAY-IEFWYSICSA-N
Boiling Point
550.9ºC at 760 mmHg
Flash Point
212.6ºC
Density
1.52g/cm³
Appearance
crystalline
Exact Mass
294.11000
What is the molecular formula of Tutin?

The molecular formula of Tutin is C15H18O6.

What are the synonyms of Tutin?

The synonyms of Tutin include Tutine, Tutu, Toot poison, (+)-Tutin, and more.

What is the IUPAC name of Tutin?

The IUPAC name of Tutin is (1S,2R,3S,5R,6R,7R,8S,9R,12R)-2,8-dihydroxy-7-methyl-12-prop-1-en-2-ylspiro[4,10-dioxatetracyclo[7.2.1.02,7.03,5]dodecane-6,2'-oxirane]-11-one.

What is the InChI of Tutin?

The InChI of Tutin is InChI=1S/C15H18O6/c1-5(2)6-7-12(17)20-8(6)9(16)13(3)14(4-19-14)10-11(21-10)15(7,13)18/h6-11,16,18H,1,4H2,2-3H3/t6-,7+,8+,9+,10+,11-,13-,14+,15-/m0/s1.

What is the InChIKey of Tutin?

The InChIKey of Tutin is CCAZWUJBLXKBAY-ULZPOIKGSA-N.

What is the canonical SMILES of Tutin?

The canonical SMILES of Tutin is CC(=C)C1C2C(C3(C4(CO4)C5C(C3(C1C(=O)O2)O)O5)C)O.

What is the CAS number of Tutin?

The CAS number of Tutin is 2571-22-4.

What is the molecular weight of Tutin?

The molecular weight of Tutin is 294.30g/mol.

How many hydrogen bond donor counts does Tutin have?

Tutin has 2 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does Tutin have?

Tutin has 6 hydrogen bond acceptor counts.

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