[email protected]
CAS 35286-58-9 3-O-alpha-L-Arabinopyranosylpomolic acid beta-D-glucopyranosyl ester molecular structure lightbox
CAS RN: 35286-58-9

3-O-alpha-L-Arabinopyranosylpomolic acid beta-D-glucopyranosyl ester

Product Availability

Choose a grade to view its available package options.

6 package records5 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250326 100mg In stock Shanghai Inquiry
Batchno.20260517 10mg In stock Shanghai Inquiry
Batchno.20251010 1g Out of stock Inquiry
Batchno.20251102 25mg In stock Shanghai Inquiry
Batchno.20260529 50mg In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250816 10mg / 25mg / 100mg Confirm by inquiry Shanghai Inquiry
  • Product code: starshine_CAS35286-58-9
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

35286-58-9 / [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 1-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-10-(3,4,5-trihydroxyoxan-2-yl)oxy-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate

Standard CAS: 35286-58-9 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
35286-58-9
Multi CAS
Yes
Molecular Formula
C41H66O13
Molecular Weight
767.000000
Exact Mass
766.450342
InChI
InChI=1S/C41H66O13/c1-20-10-15-41(35(49)54-34-31(48)29(46)28(45)23(18-42)52-34)17-16-38(5)21(32(41)40(20,7)50)8-9-25-37(4)13-12-26(36(2,3)24(37)11-14-39(25,38)6)53-33-30(47)27(44)22(43)19-51-33/h8,20,22-34,42-48,50H,9-19H2,1-7H3/t20-,22+,23-,24+,25-,26+,27+,28-,29+,30-,31-,32-,33+,34+,37+,38-,39-,40-,41+/m1/s1
InChIKey
WCHBFWOEFOZHMK-MLHVESHNSA-N

Computed Properties

Structural Parameters

Heavy atom count
54
Fraction Csp3
0.93
Rotatable bonds
5
H-bond acceptors
13
H-bond donors
8
Molar refractivity
192.92
TPSA
215.83

LogP / Solubility

WLOGP
1.93
MLOGP
1.76
XLogP3
2.6
Consensus LogP
2.1
Log S (ESOL)
-5.48
Class (ESOL)
Slightly soluble
Log S (Ali)
-7.24
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.84
Class (SILICOS-IT)
Insoluble

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)
-6.03

Drug-likeness / Medicinal Chemistry

Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10

Customers Also Viewed

Get In Touch

Contact Us