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(3aS,5aR,9R,9aS,9bS)-Decahydro-9-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one

(3aS,5aR,9R,9aS,9bS)-Decahydro-9-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one structure

CAS No:
27652-22-8
Formula:
C15H22O3
Chemical Name:
(3aS,5aR,9R,9aS,9bS)-Decahydro-9-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
Synonyms:
Naphtho[1,2-b]furan-2(3H)-one,decahydro-9-hydroxy-5a,9-dimethyl-3-methylene-,(3aS,5aR,9R,9aS,9bS)-;4αH-Eudesm-11(13)-en-12-oic acid,4,6α-dihydroxy-,γ-lactone;Naphtho[1,2-b]furan-2(3H)-one,decahydro-9-hydroxy-5a,9-dimethyl-3-methylene-,[3aS-(3aα,5aβ,9α,9aα,9bβ)]-;(3aS,5aR,9R,9aS,9bS)-Decahydro-9-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one;Arbusculin A;(+)-Arbusculin A

Description

ChEBI: A sesquiterpene lactone isolated from Saussureae Radix and has been shown to exhibit inhibitory activity against melanogenesis.

Arbusculin A is a sesquiterpene lactone isolated from Saussureae Radix and has been shown to exhibit inhibitory activity against melanogenesis. It has a role as a melanin synthesis inhibitor and a metabolite. It is an organic heterotricyclic compound, a sesquiterpene lactone and a tertiary alcohol.

(3aS,5aR,9R,9aS,9bS)-Decahydro-9-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one Basic Attributes

Molecular Weight：

250.336

Exact Mass：

250.33

UNII：

5ML8H8S9IS

Characteristics

PSA：

46.5

XLogP3：

2.43540

Density：

1.14g/cm3

Melting Point：

75-77 °C @ Solvent: Chloroform

Boiling Point：

402.7ºC at 760mmHg

Flash Point：

168.8ºC

Refractive Index：

1.538

Drug Information

MeSH Entry Terms：

arbusculin A

Computed Properties

Molecular Weight:250.33
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:250.15689456
Monoisotopic Mass:250.15689456
Topological Polar Surface Area:46.5
Heavy Atom Count:18
Complexity:416
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (3aS,5aR,9R,9aS,9bS)-Decahydro-9-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties

(3aS,5aR,9R,9aS,9bS)-Decahydro-9-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one

SDS

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