Friedelin structure, CAS 559-74-0

Friedelin

CAS Number559-74-0

SynonymsD:A-Friedooleanan-3-one; Einecs 209-205-1; 3-oxofriedelane; 3-friedelanone; Friedeline; FRIEDELAN-3-ONE; Friedelin; friedelane-3-one

Molecular FormulaC30H50O

Molecular Weight426.72

Purity≥95.0 (HPLC)%

Density1.0±0.1 g/cm3

Boiling Point477.2±13.0 °C at 760 mmHg

Melting Point262-265 °C (lit.)

Flash Point

Appearancesolid

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9010633 Purity: ≥95.0 (HPLC)%
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Quality Control of [ 559-74-0 ] Purity: ≥95.0 (HPLC)% SDS Specification MoL

Chemical & Physical Properties
CAS Number559-74-0
Catalog No.2A-9010633
Chinese Name无羁萜,木栓酮
SynonymsD:A-Friedooleanan-3-one; Einecs 209-205-1; 3-oxofriedelane; 3-friedelanone; Friedeline; FRIEDELAN-3-ONE; Friedelin; friedelane-3-one
Molecular FormulaC30H50O
Molecular Weight426.72
Purity≥95.0 (HPLC)
Density1.0±0.1 g/cm3
Boiling Point477.2±13.0 °C at 760 mmHg
Melting Point262-265 °C (lit.)
Appearancesolid
Storage Condition2-8℃
ApplicationFriedelin is isolated from the leaves of Maytenus ilicifolia(Mart). Friedelin is a non-competitive inhibitor of CYP3A4 with IC50 and Ki values ​​of 10.79 μM and 6.16 μM, respectively. Friedelin is als
MDL NumberMFCD00017296
SMILESC[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]3[C@@]2(C)CC[C@@]4(C)[C@@H]5CC(C)(C)CC[C@]5(C)CC[C@]34C
InChI1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/t20-,22+,23-,24+,26+,27+,28-,29+,30-/m0/s1
InChI KeyOFMXGFHWLZPCFL-SVRPQWSVSA-N
Beilstein/REAXYS1916451
NACRES CodeNA.24
UNSPSC41116107
MSDSmsds/10633_1_559_74_0.pdf
BioactivityFriedelin is isolated from isolated from the leaves of Maytenus ilicifolia(Mart). Friedelin is a noncompetitive inhibitor of CYP3A4 with IC50 and Kivalues of 10.79 μM and 6.16 μM, respectively. Friedelin is also a competitive inhibitor of CYP2E1 with IC50 and Ki values of 22.54 μM and 18.02 μM, respectively[1]. Related Catalog Research Areas >> Others Target IC50: 10.79 μM (CYP3A4), 22.54 μM (CYP2E1); Ki: 6.16 μM(CYP3A4), 18.02 μM(CYP2E1)[1] References [1]. Wei J, et al. In vitro inhibitory effects of Friedelin on human liver cytochrome P450 enzymes. Pharm Biol. 2018 Dec;56(1):363-367. Chemical & Physical Properties Density 1.0±0.1 g/cm3 Boiling Point 477.2±13.0 °C at 760 mmHg Melting Point 262-265ºC(lit.) Molecular Formula C30H50O Molecular Weight 426.717 Flash Point 233.9±12.1 °C Exact Mass 426.386169 PSA 17.07000 LogP 10.87 Vapour Pressure 0.0±1.2 mmHg at 25°C Index of Refraction 1.503 InChIKey OFMXGFHWLZPCFL-SVRPQWSVSA-N SMILES CC1C(=O)CCC2C1(C)CCC1C2(C)CCC2(C)C3CC(C)(C)CCC3(C)CCC12C Storage condition 2-8℃
Use ofFriedelin is isolated from isolated from the leaves of Maytenus ilicifolia(Mart). Friedelin is a noncompetitive inhibitor of CYP3A4 with IC50 and Kivalues of 10.79 μM and 6.16 μM, respectively. Friedelin is also a competitive inhibitor of CYP2E1 with IC50 and Ki values of 22.54 μM and 18.02 μM, respectively[1]. Properties Name friedelin Synonym More Synonyms Friedelin Biological Activity Description Friedelin is isolated from isolated from the leaves of Maytenus ilicifolia(Mart). Friedelin is a noncompetitive inhibitor of CYP3A4 with IC50 and Kivalues of 10.79 μM and 6.16 μM, respectively. Friedelin is also a competitive inhibitor of CYP2E1 with IC50 and Ki values of 22.54 μM and 18.02 μM, respectively[1]. Related Catalog Research Areas >> Others IC50: 10.79 μM (CYP3A4), 22.54 μM (CYP2E1); Ki: 6.16 μM(CYP3A4), 18.02 μM(CYP2E1)[1] References [1]. Wei J, et al. In vitro inhibitory effects of Friedelin on human liver cytochrome P450 enzymes. Pharm Biol. 2018 Dec;56(1):363-367. Chemical & Physical Properties Molecular Formula C30H50O Exact Mass 426.386169 PSA 17.07000 LogP 10.87 Index of Refraction 1.503 InChIKey OFMXGFHWLZPCFL-SVRPQWSVSA-N Storage condition 2-8℃
Transport InfoProduct Name: Suberone
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