[email protected]
CAS 60037-39-0 G13 molecular structure lightbox
CAS RN: 60037-39-0

G13

Product Availability

Choose a grade to view its available package options.

5 package records0 with current stock2 grade groups
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260626 1mg / 5mg Out of stock 5-7 business days Inquiry
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250515 10mg Out of stock Inquiry
Batchno.20251012 1mg Out of stock Inquiry
Batchno.20260514 25mg Out of stock Inquiry
Batchno.20251006 5mg Out of stock Inquiry
  • Product code: starshine_CAS60037-39-0
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

60037-39-0 / methyl 5-ethylidene-4-[2-[[6-[2-[4-[2-[3-ethylidene-5-methoxycarbonyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-4-yl]acetyl]oxyphenyl]ethoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-2-oxoethyl]-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate

Standard CAS: 60037-39-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
60037-39-0
Multi CAS
Yes
Molecular Formula
C48H64O27
Molecular Weight
1073.000000
Exact Mass
1072.363497
InChI
InChI=1S/C48H64O27/c1-5-22-24(26(42(62)64-3)17-68-44(22)74-47-40(60)36(56)33(53)28(15-49)71-47)13-31(51)67-19-30-35(55)38(58)39(59)46(73-30)66-12-11-20-7-9-21(10-8-20)70-32(52)14-25-23(6-2)45(69-18-27(25)43(63)65-4)75-48-41(61)37(57)34(54)29(16-50)72-48/h5-10,17-18,24-25,28-30,33-41,44-50,53-61H,11-16,19H2,1-4H3/b22-5+,23-6+/t24-,25-,28+,29+,30+,33+,34+,35+,36-,37-,38-,39+,40+,41+,44-,45-,46+,47-,48-/m0/s1
InChIKey
SMSRUMQQXKEQCV-NKRYKJGSSA-N

Computed Properties

Structural Parameters

Heavy atom count
75
Aromatic heavy atom count
6
Fraction Csp3
0.62
Rotatable bonds
19
H-bond acceptors
27
H-bond donors
11
Molar refractivity
242.75
TPSA
401.57

LogP / Solubility

WLOGP
-4.13
MLOGP
-3.53
XLogP3
-3.9
Consensus LogP
-3.85
Log S (ESOL)
-2.69
Class (ESOL)
Moderately soluble
Log S (Ali)
-5.37
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.48
Class (SILICOS-IT)
Slightly 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)
-12.2

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