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CAS 34620-78-5 MALTOHEPTAOSE molecular structure lightbox
CAS RN: 34620-78-5

MALTOHEPTAOSE

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8 package records8 with current stock2 grade groups
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250816 100mg In stock Shanghai, Shenzhen, Tianjin, Chengdu Inquiry
Batchno.20251222 1g In stock Shanghai Inquiry
Batchno.20250325 250mg In stock Shanghai Inquiry
Batchno.20250426 25mg In stock Shanghai Inquiry
Batchno.20260607 50mg In stock Shanghai, Tianjin Inquiry
Batchno.20250605 5g In stock Shanghai Inquiry
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20250204 20mg In stock Shanghai Inquiry
Batchno.20251226 50mg In stock Shandong Inquiry
  • Product code: starshine_CAS34620-78-5
  • Purity/Analytical Methods: >99.0%
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34620-78-5 / (2R,3R,4R,5R)-4-[(2R,3R,4R,5S,6R)-5-[(2R,3R,4R,5S,6R)-5-[(2R,3R,4R,5S,6R)-5-[(2R,3R,4R,5S,6R)-5-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,5,6-tetrahydroxyhexanal

Standard CAS: 34620-78-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
34620-78-5
Multi CAS
Yes
Molecular Formula
C42H72O36
Molecular Weight
1153.000000
Exact Mass
1152.380329
InChI
InChI=1S/C42H72O36/c43-1-9(51)17(53)31(10(52)2-44)73-38-26(62)20(56)33(12(4-46)68-38)75-40-28(64)22(58)35(14(6-48)70-40)77-42-30(66)24(60)36(16(8-50)72-42)78-41-29(65)23(59)34(15(7-49)71-41)76-39-27(63)21(57)32(13(5-47)69-39)74-37-25(61)19(55)18(54)11(3-45)67-37/h1,9-42,44-66H,2-8H2/t9-,10+,11+,12+,13+,14+,15+,16+,17+,18+,19-,20+,21+,22+,23+,24+,25+,26+,27+,28+,29+,30+,31+,32+,33+,34+,35+,36+,37+,38+,39+,40+,41+,42+/m0/s1
InChIKey
ZHZITDGOAFCURV-VVTKTIMZSA-N

Computed Properties

Structural Parameters

Heavy atom count
78
Fraction Csp3
0.98
Rotatable bonds
23
H-bond acceptors
36
H-bond donors
23
Molar refractivity
232.98
TPSA
593.12

LogP / Solubility

WLOGP
-16.43
MLOGP
-14.35
XLogP3
-15.8
Consensus LogP
-15.53
Log S (ESOL)
4.88
Class (ESOL)
Highly soluble
Log S (Ali)
2.85
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
3.73
Class (SILICOS-IT)
Highly 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)
-21.42

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

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