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CAS 64820-99-1 Vitexin-2-O-rhamnoside molecular structure lightbox
CAS RN: 64820-99-1

Vitexin-2-O-rhamnoside

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4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260615 100mg In stock Shanghai Inquiry
Batchno.20250406 1g Out of stock Inquiry
Batchno.20260612 250mg In stock Shanghai Inquiry
Batchno.20251127 50mg / 100mg / 500mg Confirm by inquiry Shanghai, Shandong Inquiry
  • Product code: starshine_CAS64820-99-1
  • Purity/Analytical Methods: >99.0%
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64820-99-1 / 8-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one

Standard CAS: 64820-99-1 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
64820-99-1
Multi CAS
Yes
Molecular Formula
C27H30O14
Molecular Weight
578.500000
Exact Mass
578.163556
InChI
InChI=1S/C27H30O14/c1-9-19(33)21(35)23(37)27(38-9)41-26-22(36)20(34)16(8-28)40-25(26)18-13(31)6-12(30)17-14(32)7-15(39-24(17)18)10-2-4-11(29)5-3-10/h2-7,9,16,19-23,25-31,33-37H,8H2,1H3/t9-,16+,19-,20+,21+,22-,23+,25-,26+,27-/m0/s1
InChIKey
LYGPBZVKGHHTIE-HUBYJIGHSA-N

Computed Properties

Structural Parameters

Heavy atom count
41
Aromatic heavy atom count
16
Fraction Csp3
0.44
Rotatable bonds
5
H-bond acceptors
14
H-bond donors
9
Molar refractivity
136.86
TPSA
239.97

LogP / Solubility

WLOGP
-1.06
MLOGP
-0.88
XLogP3
-0.9
Consensus LogP
-0.95
Log S (ESOL)
-2.72
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.54
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.14
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
Yes
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-7

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Leadlikeness
No
Synthetic Accessibility
10

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