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CAS 62574-30-5 11R,12-Dihydroxyspirovetiv-1(10)-en-2-one molecular structure lightbox
CAS RN: 62574-30-5

11R,12-Dihydroxyspirovetiv-1(10)-en-2-one

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2 package records0 with current stock2 grade groups
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Batchno.20260606 5mg Out of stock 30 business days Inquiry
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Batchno.20250717 5mg Out of stock Inquiry
  • Product code: starshine_CAS62574-30-5
  • Purity/Analytical Methods: >99.0%
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62574-30-5 / (3R,5S,6R)-3-[(2R)-1,2-dihydroxypropan-2-yl]-6,10-dimethylspiro[4.5]dec-9-en-8-one

Standard CAS: 62574-30-5 Multi CAS: Yes
Basic Information Computed Properties

Basic Information

CAS
62574-30-5
Multi CAS
Yes
Molecular Formula
C15H24O3
Molecular Weight
252.350000
Exact Mass
252.172545
InChI
InChI=1S/C15H24O3/c1-10-6-13(17)7-11(2)15(10)5-4-12(8-15)14(3,18)9-16/h6,11-12,16,18H,4-5,7-9H2,1-3H3/t11-,12-,14+,15-/m1/s1
InChIKey
FWLWCLDHPUPCHO-RJZRQDKASA-N

Computed Properties

Structural Parameters

Heavy atom count
18
Fraction Csp3
0.8
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
2
Molar refractivity
70.03
TPSA
57.53

LogP / Solubility

WLOGP
2.07
MLOGP
1.83
XLogP3
1.2
Consensus LogP
1.7
Log S (ESOL)
-2.58
Class (ESOL)
Moderately soluble
Log S (Ali)
-3.12
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.26
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.79

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
4.5

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