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Neotriptophenolide

Neotriptophenolide structure

Neotriptophenolide 

structure
  • CAS No:

    81827-74-9

  • Formula:

    C21H26O4

  • Chemical Name:

    Neotriptophenolide

  • Synonyms:

    Phenanthro[1,2-c]furan-1(3H)-one,3b,4,5,9b,10,11-hexahydro-9-hydroxy-6-methoxy-9b-methyl-7-(1-methylethyl)-,(3bR,9bS)-;Phenanthro[1,2-c]furan-1(3H)-one,3b,4,5,9b,10,11-hexahydro-9-hydroxy-6-methoxy-9b-methyl-7-(1-methylethyl)-,(3bR-trans)-;(3bR,9bS)-3b,4,5,9b,10,11-Hexahydro-9-hydroxy-6-methoxy-9b-methyl-7-(1-methylethyl)phenanthro[1,2-c]furan-1(3H)-one;Neotriptophenolide

Description

Neotriptophenolide is a sesquiterpene pyridine alkaloid isolated from the root barks of Tripterygium hypoglaucum[1].


Neotriptophenolide is a tetracyclic diterpenoid with formula C21H26O4, originally isolated from Tripterygium wilfordii and Tripterygium hypoglaucum It has a role as a plant metabolite. It is a gamma-lactone, an aromatic ether, a member of phenols, an organic heterotetracyclic compound and a tetracyclic triterpenoid.

Neotriptophenolide Basic Attributes

342.435

342.43

Characteristics

55.8

3.75

1.2±0.1 g/cm3

189-191 °C

563.2±50.0 °C at 760 mmHg

200.4±23.6 °C

1.595

Drug Information

neotriptophenolide

Computed Properties

Molecular Weight:342.4
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:342.18310931
Monoisotopic Mass:342.18310931
Topological Polar Surface Area:55.8
Heavy Atom Count:25
Complexity:595
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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