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CAS 1275612-13-9 H-β-HoGlu(OtBu)-OH molecular structure lightbox
CAS RN: 1275612-13-9

H-β-HoGlu(OtBu)-OH

Product Availability

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1 package records1 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20251122 100mg / 250mg / 1g / 5g Confirm by inquiry Shanghai 8-10 business days Inquiry
  • Product code: SSC-035069
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 0.1g, 0.25g, 5g
  • Available purity: 97%
  • Inventory rows with stock: 2
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1275612-13-9
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g 97% 3 In Stock Shanghai Inquiry
0.1g 97% 1 In Stock Hong Kong Inquiry
0.25g 97% 0 Out of Stock Beijing Inquiry
5g 97% 0 Out of Stock Hong Kong Inquiry

1275612-13-9 / (3S)-3-amino-6-[(2-methylpropan-2-yl)oxy]-6-oxohexanoic acid

Standard CAS: 1275612-13-9 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1275612-13-9
Multi CAS
No
Molecular Formula
C10H19NO4
Molecular Weight
217.260000
Exact Mass
217.131408
SMILES
CC(C)(C)OC(=O)CC[C@@H](CC(=O)O)N
InChI
InChI=1S/C10H19NO4/c1-10(2,3)15-9(14)5-4-7(11)6-8(12)13/h7H,4-6,11H2,1-3H3,(H,12,13)/t7-/m0/s1
InChIKey
KTBUSUJXAJYYFG-ZETCQYMHSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.8
Rotatable bonds
5
H-bond acceptors
4
H-bond donors
2
Molar refractivity
55.31
TPSA
89.62

LogP / Solubility

WLOGP
0.91
MLOGP
0.8
XLogP3
-2.3
Consensus LogP
-0.2
Log S (ESOL)
-1.43
Class (ESOL)
Soluble
Log S (Ali)
-2
Class (Ali)
Soluble
Log S (SILICOS-IT)
-2.43
Class (SILICOS-IT)
Moderately 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)
-3.4

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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