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CAS 18918-31-5 P-NITROPHENYL 6-DEOXY-ALPHA-L-MANNOPYRANOSIDE molecular structure lightbox
CAS RN: 18918-31-5

P-NITROPHENYL 6-DEOXY-ALPHA-L-MANNOPYRANOSIDE

Product Availability

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7 package records5 with current stock4 grade groups
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250924 50mg / 250mg / 1g Confirm by inquiry Shanghai, Guangdong, Chongqing, Hebei Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260602 100mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250718 1g In stock Shanghai, Shenzhen Inquiry
Batchno.20250307 250mg In stock Shanghai, Tianjin, Chengdu Inquiry
Batchno.20250224 5g Out of stock Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260419 50mg Out of stock 8-10 business days Inquiry
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20260305 50mg / 250mg / 1g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: starshine_CAS18918-31-5
  • Purity/Analytical Methods: >99.0%
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18918-31-5 / (2S,3R,4R,5R,6S)-2-methyl-6-(4-nitrophenoxy)oxane-3,4,5-triol

Standard CAS: 18918-31-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
18918-31-5
Multi CAS
No
Molecular Formula
C12H15NO7
Molecular Weight
285.250000
Exact Mass
285.084852
SMILES
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=CC=C(C=C2)[N+](=O)[O-])O)O)O
InChI
InChI=1S/C12H15NO7/c1-6-9(14)10(15)11(16)12(19-6)20-8-4-2-7(3-5-8)13(17)18/h2-6,9-12,14-16H,1H3/t6-,9-,10+,11+,12-/m0/s1
InChIKey
YILIDCGSXCGACV-UOAXWKJLSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
3
H-bond acceptors
7
H-bond donors
3
Molar refractivity
66.08
TPSA
122.29

LogP / Solubility

WLOGP
-0.2
MLOGP
-0.16
XLogP3
0.1
Consensus LogP
-0.09
Log S (ESOL)
-1.51
Class (ESOL)
Soluble
Log S (Ali)
-1.76
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.71
Class (SILICOS-IT)
Soluble

ADME

GI absorption
High
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)
-4.6

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
4

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