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CAS 91464-90-3 GAMMA-CYCLODEXTRIN HYDRATE molecular structure lightbox
CAS RN: 91464-90-3

GAMMA-CYCLODEXTRIN HYDRATE

Product Availability

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5 package records5 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20251220 100g In stock Shanghai, Shenzhen, Wuhan, Chengdu Inquiry
Batchno.20260422 10g In stock Shanghai Inquiry
Batchno.20260124 25g In stock Shanghai, Shenzhen, Tianjin, Wuhan, Chengdu Inquiry
Batchno.20250918 500g In stock Shenzhen, Tianjin, Wuhan Inquiry
Batchno.20250825 5g In stock Shanghai, Tianjin Inquiry
  • Product code: SSC-204645
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 100g
  • Available purity: ＞97%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 91464-90-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
100g ＞97% 0 Out of Stock Hong Kong Inquiry

91464-90-3 / 5,10,15,20,25,30,35,40-octakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34,37,39-hexadecaoxanonacyclo[36.2.2.23,6.28,11.213,16.218,21.223,26.228,31.233,36]hexapentacontane-41,42,43,44,45,46,47,48,49,50,51,52,53,54,55,56-hexadecol;hydrate

Standard CAS: 91464-90-3 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
91464-90-3
Multi CAS
Yes
Molecular Formula
C48H82O41
Molecular Weight
1315.100000
Exact Mass
1314.433152
InChI
InChI=1S/C48H80O40.H2O/c49-1-9-33-17(57)25(65)41(73-9)82-34-10(2-50)75-43(27(67)19(34)59)84-36-12(4-52)77-45(29(69)21(36)61)86-38-14(6-54)79-47(31(71)23(38)63)88-40-16(8-56)80-48(32(72)24(40)64)87-39-15(7-55)78-46(30(70)22(39)62)85-37-13(5-53)76-44(28(68)20(37)60)83-35-11(3-51)74-42(81-33)26(66)18(35)58;/h9-72H,1-8H2;1H2
InChIKey
SPKUKQHKKVTYOE-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
89
Fraction Csp3
1
Rotatable bonds
8
H-bond acceptors
40
H-bond donors
24
Molar refractivity
264.68
TPSA
664.7

LogP / Solubility

WLOGP
-18.23
MLOGP
-15.91
XLogP3
-18.23
Consensus LogP
-17.46
Log S (ESOL)
4.02
Class (ESOL)
Highly soluble
Log S (Ali)
2.82
Class (Ali)
Highly soluble
Log S (SILICOS-IT)
5.96
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)
-23.69

Drug-likeness / Medicinal Chemistry

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

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