[email protected]
CAS 10391-09-0 Nodosin molecular structure lightbox
CAS RN: 10391-09-0

Nodosin

Product Availability

Choose a grade to view its available package options.

4 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseInquiry
Batchno.20260310 10mg In stock Shanghai Inquiry
Batchno.20251103 25mg In stock Shanghai Inquiry
Batchno.20250914 50mg In stock Shanghai Inquiry
Batchno.20260521 5mg In stock Shanghai Inquiry
  • Product code: starshine_CAS10391-09-0
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

10391-09-0 / (1S,4S,8R,9R,12S,13S,14R,16S)-9,14-dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione

Epindosin | 9,14-Dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione | KAA39109

Standard CAS: 10391-09-0 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
10391-09-0
Multi CAS
Yes
Molecular Formula
C20H26O6
Molecular Weight
362.400000
Exact Mass
362.172939
SMILES
CC1(CC[C@H]2[C@]3([C@@H]1[C@@H](OC3)O)[C@@H]4[C@@H](C[C@@H]5C[C@]4(C(=O)C5=C)C(=O)O2)O)C
InChI
InChI=1S/C20H26O6/c1-9-10-6-11(21)13-19(7-10,15(9)22)17(24)26-12-4-5-18(2,3)14-16(23)25-8-20(12,13)14/h10-14,16,21,23H,1,4-8H2,2-3H3/t10-,11-,12+,13-,14-,16-,19+,20+/m1/s1
InChIKey
WZYJEEIAFBHYJS-SONIPUFESA-N
Synonyms
Epindosin 9,14-Dihydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.01,13.04,12.08,12]nonadecane-2,18-dione KAA39109 NSC285659 NSC-285659

Computed Properties

Structural Parameters

Heavy atom count
26
Fraction Csp3
0.8
H-bond acceptors
6
H-bond donors
2
Molar refractivity
89.58
TPSA
93.06

LogP / Solubility

WLOGP
1.2
MLOGP
1.07
XLogP3
1.5
Consensus LogP
1.26
Log S (ESOL)
-2.84
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.39
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.01
Class (SILICOS-IT)
Poorly 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)
-4.08

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
10

Customers Also Viewed

Get In Touch

Contact Us