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Nomilin

Nomilin structure

Nomilin 

structure
  • CAS No:

    1063-77-0

  • Formula:

    C28H34O9

  • Chemical Name:

    Nomilin

  • Synonyms:

    Oxireno[4,4a]-2-benzopyrano[6,5-g][2]benzoxepin-3,5,9(3aH,4bH,6H)-trione,11-(acetyloxy)-1-(3-furanyl)decahydro-4b,7,7,11a,13a-pentamethyl-,(1S,3aS,4aR,4bR,6aR,11S,11aR,11bR,13aS)-;Oxireno[4,4a]-2-benzopyrano[6,5-g][2]benzoxepin-3,5,9(3aH,4bH,6H)-trione,1-(3-furyl)decahydro-11-hydroxy-4b,7,7,11a,13a-pentamethyl-,acetate;Nomilin;Obacunoic acid,1-(acetyloxy)-1,2-dihydro-,ε-lactone;(1S,3aS,4aR,4bR,6aR,11S,11aR,11bR,13aS)-11-(Acetyloxy)-1-(3-furanyl)decahydro-4b,7,7,11a,13a-pentamethyloxireno[4,4a]-2-benzopyrano[6,5-g][2]benzoxepin-3,5,9(3aH,4bH,6H)-trione;Oxireno[4,4a]-2-benzopyrano[6,5-g][2]benzoxepin-3,5,9(3aH,4bH,6H)-trione,11-(acetyloxy)-1-(3-furanyl)decahydro-4b,7,7,11a,13a-pentamethyl-,[1S-(1α,3aα,4aS*,4bβ,6aα,11α,11aβ,11bα,13aα)]-;NSC 297134

  • Categories:

    Biochemical Engineering  >  Biosynthetic Natural Products

Description

Yellow powder


Nomilin is a limonoid.

Nomilin Basic Attributes

514.56

514.56

DRM0753K4T

29322090

Characteristics

122

3.69020

Slightly Off-white solid

1.33±0.1 g/cm3(Predicted)

278-279 °C (decomp)

657.7±55.0 °C(Predicted)

351.6±31.5 °C

1.575

Keep container tightly closed.

3.57E-17mmHg at 25°C

D23 -95.7°

Safety Information

NONH for all modes of transport

3

24/25

Stable at normal temperatures and pressures.

Drug Information

nomilin

Computed Properties

Molecular Weight:514.6
XLogP3:2.6
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:3
Exact Mass:514.22028266
Monoisotopic Mass:514.22028266
Topological Polar Surface Area:122
Heavy Atom Count:37
Complexity:1080
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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