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Baeocystin

Baeocystin structure

CAS No:
21420-58-6
Formula:
C11H15N2O4P
Chemical Name:
Baeocystin
Synonyms:
1H-Indol-4-ol,3-[2-(methylamino)ethyl]-,4-(dihydrogen phosphate);Indol-4-ol,3-[2-(methylamino)ethyl]-,dihydrogen phosphate (ester);1H-Indol-4-ol,3-[2-(methylamino)ethyl]-,dihydrogen phosphate (ester);Baeocystin;Beocystin;[3-[2-(Methylamino)ethyl]-1H-indol-4-yl] dihydrogen phosphate;11044-29-4
Categories:
Organic Chemistry > Phosphines

Description

Baeocystin is a tryptamine alkaloid that is N-methyltryptamine carrying an additional phosphoryloxy substituent at position 4. It has a role as a hallucinogen and a fungal metabolite. It is an organic phosphate, a tryptamine alkaloid and a secondary amino compound. It derives from a tryptamine. It is a conjugate acid of a baeocystin(1-).

Baeocystin Basic Attributes

Molecular Weight：

270.224

Exact Mass：

270.22

UNII：

22KW205WF2

DSSTox ID：

DTXSID70175693

Characteristics

PSA：

94.6

XLogP3：

-2.1

Density：

1.447±0.06 g/cm3(Predicted)

Melting Point：

254-258 °C (decomp)

Drug Information

MeSH Entry Terms：

baeocystin

Computed Properties

Molecular Weight:270.22
XLogP3:-2.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:270.07694396
Monoisotopic Mass:270.07694396
Topological Polar Surface Area:94.6
Heavy Atom Count:18
Complexity:322
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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