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CAS 90695-03-7 (2Z,6Z,10E,14E,18E)-Farnesylfarnesol molecular structure lightbox
CAS RN: 90695-03-7

(2Z,6Z,10E,14E,18E)-Farnesylfarnesol

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260310 5mg Out of stock 30 business days Inquiry
  • Product code: starshine_CAS90695-03-7
  • Purity/Analytical Methods: >99.0%
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90695-03-7 / (2Z,6Z,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-ol

Standard CAS: 90695-03-7 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
90695-03-7
Multi CAS
Yes
Molecular Formula
C30H50O
Molecular Weight
426.700000
Exact Mass
426.386166
InChI
InChI=1S/C30H50O/c1-25(2)13-8-14-26(3)15-9-16-27(4)17-10-18-28(5)19-11-20-29(6)21-12-22-30(7)23-24-31/h13,15,17,19,21,23,31H,8-12,14,16,18,20,22,24H2,1-7H3/b26-15+,27-17+,28-19+,29-21-,30-23-
InChIKey
RXILURRBPAWICG-UQUNVEFSSA-N

Computed Properties

Structural Parameters

Heavy atom count
31
Fraction Csp3
0.6
Rotatable bonds
16
H-bond acceptors
1
H-bond donors
1
Molar refractivity
141.47
TPSA
20.23

LogP / Solubility

WLOGP
9.58
MLOGP
8.46
XLogP3
10.3
Consensus LogP
9.45
Log S (ESOL)
-7.46
Class (ESOL)
Insoluble
Log S (Ali)
-9.97
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-12.3
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
1.48

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
2.5

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