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CAS 97653-93-5 Lucidone B molecular structure lightbox
CAS RN: 97653-93-5

Lucidone B

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250218 2mg Out of stock 5-7 business days Inquiry
  • Product code: starshine_CAS97653-93-5
  • Purity/Analytical Methods: >99.0%
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97653-93-5 / 17-acetyl-7-hydroxy-4,4,10,13,14-pentamethyl-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthrene-3,11,15-trione

Standard CAS: 97653-93-5 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
97653-93-5
Multi CAS
Yes
Molecular Formula
C24H32O5
Molecular Weight
400.500000
Exact Mass
400.224974
InChI
InChI=1S/C24H32O5/c1-12(25)13-9-18(29)24(6)20-14(26)10-16-21(2,3)17(28)7-8-22(16,4)19(20)15(27)11-23(13,24)5/h13-14,16,26H,7-11H2,1-6H3
InChIKey
AJULRUMEMZKBQI-UHFFFAOYSA-N

Physical Properties

Melting Point
270 - 271 °C
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
29
Fraction Csp3
0.75
Rotatable bonds
1
H-bond acceptors
5
H-bond donors
1
Molar refractivity
106.9
TPSA
88.51

LogP / Solubility

WLOGP
3.22
MLOGP
2.86
XLogP3
0.9
Consensus LogP
2.33
Log S (ESOL)
-4.29
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.17
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.06
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-2.88

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
6

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