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CAS 310888-07-4 5,7,3′-trihydroxy-6, 4′,5′-trimethoxyflavanone molecular structure lightbox
CAS RN: 310888-07-4

5,7,3′-trihydroxy-6, 4′,5′-trimethoxyflavanone

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250730 5mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS310888-07-4
  • Purity/Analytical Methods: >99.0%
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310888-07-4 / 5,7-dihydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-2,3-dihydrochromen-4-one

Standard CAS: 310888-07-4 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
310888-07-4
Multi CAS
Yes
Molecular Formula
C18H18O8
Molecular Weight
362.300000
Exact Mass
362.100168
InChI
InChI=1S/C18H18O8/c1-23-14-5-8(4-10(20)17(14)24-2)12-6-9(19)15-13(26-12)7-11(21)18(25-3)16(15)22/h4-5,7,12,20-22H,6H2,1-3H3/t12-/m0/s1
InChIKey
HMTSHCGCQPCGLA-LBPRGKRZSA-N

Computed Properties

Structural Parameters

Heavy atom count
26
Aromatic heavy atom count
12
Fraction Csp3
0.28
Rotatable bonds
4
H-bond acceptors
8
H-bond donors
3
Molar refractivity
89.85
TPSA
114.68

LogP / Solubility

WLOGP
2.54
MLOGP
2.25
XLogP3
2.3
Consensus LogP
2.36
Log S (ESOL)
-3.76
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.36
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.6
Class (SILICOS-IT)
Slightly soluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-3.13

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3

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