Cas no 54984-93-9 (1,4-naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-)

1,4-naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy- structure

54984-93-9 structure

Product Name:1,4-naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-

CAS No:54984-93-9

MF:C₁₈H₁₈O₆

MW:330.331925868988

CID:859395

PubChem ID:32464

Update Time:2025-07-13

1,4-naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy- Chemical and Physical Properties

Names and Identifiers

- 1,4-naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-
- ACETYLSHIKONIN
- (R)-1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-4-methylpent-3-enyl acetate
- 1,4-Naphthalenedione, 2-(1-(acetyloxy)-4-methyl-3-pentenyl)-5,8-dihydroxy-
- 1'O-acetylshikonin
- 2-[1-(acetyloxy)-4-methyl-3-pentenyl]naphthazarin
- acethylshikonin
- shikonin acetate
- DL-Acetylshikonin
- 1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-4-methylpent-3-en-1-yl acetate
- ARNEBIN-3
- Alkannin, monoacetate
- 106295-33-4
- NSC 291844
- HY-N2181A
- CHEBI:81069
- NSC140376
- CHEMBL28569
- WNFXUXZJJKTDOZ-UHFFFAOYSA-N
- ARNEBIN 3
- 24502-78-1
- DTXSID30909976
- 1, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-
- AKOS015896725
- 23444-71-5
- SCHEMBL1240671
- WNFXUXZJJKTDOZ-UHFFFAOYSA-
- ALKANNIN MONOACETATE
- [1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate
- FS-6968
- acetyl shikonin
- Shikonin, acetyl
- (R)-1-(5,8-Dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-4-methylpent-3-en-1-yl acetate
- B2703-342008
- 1, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy-, (R)-
- InChI=1/C18H18O6/c1-9(2)4-7-15(24-10(3)19)11-8-14(22)16-12(20)5-6-13(21)17(16)18(11)23/h4-6,8,15,20-21H,7H2,1-3H3
- NSC-291844
- NSC110199
- 1, 5,8-dihydroxy-2-(1-hydroxy-4-methyl-3-pentenyl)-, 2-acetate, (+)-
- CS-0368744
- BCP18130
- Q27155025
- NSC-140376
- C17413
- NSC291844
- 54984-93-9
- B671806K005
- 2-(1-acetyloxy-4-methyl-3-pentenyl)-5,8-dihydroxy-1,4-naphthoquinone
- 1ST167720
- DB-046470
- AcetylshikoninShikonin, acetyl
- Inchi： 1S/C18H18O6/c1-9(2)4-7-15(24-10(3)19)11-8-14(22)16-12(20)5-6-13(21)17(16)18(11)23/h4-6,8,15,20-21H,7H2,1-3H3
- InChI Key： WNFXUXZJJKTDOZ-UHFFFAOYSA-N
- SMILES： O(C(C)=O)C(C/C=C(\C)/C)C1=CC(C2C(=CC=C(C=2C1=O)O)O)=O

Computed Properties

Exact Mass: 330.11034
Monoisotopic Mass: 330.110338
Isotope Atom Count: 0
Hydrogen Bond Donor Count: 2
Hydrogen Bond Acceptor Count: 6
Heavy Atom Count: 24
Rotatable Bond Count: 5
Complexity: 599
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count : 1
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Topological Polar Surface Area: 101
XLogP3: 3.5

Experimental Properties

Color/Form: Powder
PSA: 100.9
LogP: 2.69120

1,4-naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy- Pricemore >>

Related Categories	No.	Product Name	Cas No.	Purity	Specification	Price	update time
ChemFaces	CFN90308-20mg	Acetylshikonin	54984-93-9	>=98%	20mg	$418	2021-07-22
SHANG HAI TAO SHU Biotechnology Co., Ltd.	TN6458-25 mg	Acetylshikonin	54984-93-9		25mg	￥4810.00	2022-03-01
ChemFaces	CFN90308-20mg	Acetylshikonin	54984-93-9	>=98%	20mg	$338	2023-09-19
A2B Chem LLC	AG34482-20mg	Acetylshikonin	54984-93-9	98%	20mg	$1640.00	2024-04-19
TargetMol Chemicals	TN6458-25 mg	Acetylshikonin	54984-93-9	98%	25mg	￥ 4,810	2023-07-11
TargetMol Chemicals	TN6458-25mg	Acetylshikonin	54984-93-9		25mg	￥ 4810	2024-07-20

1,4-naphthalenedione, 2-[1-(acetyloxy)-4-methyl-3-pentenyl]-5,8-dihydroxy- Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd

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(CAS:54984-93-9)Acetylshikonin

Order Number:LE1201

Stock Status:in Stock

Quantity:25KG,200KG,1000KG

Purity:99%

Pricing Information Last Updated:Friday, 20 June 2025 11:40

Price ($):discuss personally

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