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CAS 76045-38-0 Physalin G molecular structure lightbox
CAS RN: 76045-38-0

Physalin G

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250721 5mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS76045-38-0
  • Purity/Analytical Methods: >99.0%
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76045-38-0 / 5,15-dihydroxy-2,9,26-trimethyl-3,19,23,28-tetraoxaoctacyclo[16.9.1.118,27.01,5.02,24.08,17.09,14.021,26]nonacosa-11,13-diene-4,10,22,29-tetrone

Standard CAS: 76045-38-0 Multi CAS: Yes
Basic Information Physical Properties Computed Properties

Basic Information

CAS
76045-38-0
Multi CAS
Yes
Molecular Formula
C28H30O10
Molecular Weight
526.500000
Exact Mass
526.183897
InChI
InChI=1S/C28H30O10/c1-23-10-18-25(3)28-19(23)20(31)27(38-28,35-11-15(23)21(32)36-18)14-9-16(29)13-5-4-6-17(30)24(13,2)12(14)7-8-26(28,34)22(33)37-25/h4-6,12,14-16,18-19,29,34H,7-11H2,1-3H3/t12-,14+,15-,16+,18+,19-,23+,24+,25-,26+,27+,28-/m0/s1
InChIKey
CGVBSJOSWAZUIF-NHEONHGESA-N

Physical Properties

Melting Point
295 - 296 °C
Physical Description
Solid
State
Solid

Computed Properties

Structural Parameters

Heavy atom count
38
Fraction Csp3
0.71
H-bond acceptors
10
H-bond donors
2
Molar refractivity
123.71
TPSA
145.66

LogP / Solubility

WLOGP
0.53
MLOGP
0.5
XLogP3
-0.2
Consensus LogP
0.28
Log S (ESOL)
-3.44
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.26
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-3.52
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.56

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
10

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