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(+)-Sclareolide

(+)-Sclareolide structure

CAS No:
564-20-5
Formula:
C16H26O2
Chemical Name:
(+)-Sclareolide
Synonyms:
Naphtho[2,1-b]furan-2(1H)-one,decahydro-3a,6,6,9a-tetramethyl-,(3aR,5aS,9aS,9bR)-;Norambreinolide;Naphtho[2,1-b]furan-2(1H)-one,3a,4,5,5aα,6,7,8,9,9a,9bα-decahydro-3aβ,6,6,9aβ-tetramethyl-;Naphtho[2,1-b]furan-2(1H)-one,decahydro-3a,6,6,9a-tetramethyl-,[3aR-(3aα,5aβ,9aα,9bβ)]-;(3aR,5aS,9aS,9bR)-Decahydro-3a,6,6,9a-tetramethylnaphtho[2,1-b]furan-2(1H)-one;(+)-Norambreinolide;Norambreinolid;(+)-Sclareolide;Sclareolide;(R)-(+)-Sclareolide;13,14,15,16-Tetranorlabdano-8α,12-lactone;(3αR)-(+)-Sclareolide;(3aR)-(+)-Sclareolide;(3AR,5aS,9aS,9bR)-3a,6,6,9a-tetramethyldecahydronaphtho[2,1-b]furan-2(1H)-one
Categories:
Cosmetic Ingredient > Perfuming

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Description

Sclareolide is isolated from the flower of Salvia sclarea with antibacterial and cytotoxic activities[1].

White crystalline powder; warm musky or woody aroma

Norambreinolide is a naphthofuran.

(+)-Sclareolide Basic Attributes

Molecular Weight：

250.38

Exact Mass：

250.38

EC Number：

209-269-0

UNII：

37W4O0O6E6

DSSTox ID：

DTXSID8047686

HScode：

29322090

Characteristics

PSA：

26.3

XLogP3：

4.32

Appearance：

White crystalline powder; warm musky or woody aroma

Density：

1.0±0.1 g/cm3

Melting Point：

125 °C

Boiling Point：

321.4±10.0 °C at 760 mmHg

Flash Point：

132.4±16.4 °C

Refractive Index：

1.490

Water Solubility：

Insoluble in water and oils; soluble in acetone and toluene

Specific rotation：

47 º(c=2, chloroform)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

24/25

Precautionary statement(s)：

P264, P280, P305+P351+P338, P33, P313

Hazard Statements：

H319

GHS Classification：

Not Classified

Drug Information

MeSH Entry Terms：

sclareolide

(+)-Sclareolide Use and Manufacturing

Uses

antimicrobial

Manufacturing Info：

Naphtho[2,1-b]furan-2(1H)-one, decahydro-3a,6,6,9a-tetramethyl-, (3aR,5aS,9aS,9bR)-: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:250.38
XLogP3:4.3
Hydrogen Bond Acceptor Count:2
Exact Mass:250.193280068
Monoisotopic Mass:250.193280068
Topological Polar Surface Area:26.3
Heavy Atom Count:18
Complexity:387
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (+)-Sclareolide

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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(+)-Sclareolide

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