Research chemical
CAS Number: 170894-20-9
![(2S,4aS,8aS)-2-[[(2R,3R,4R,4aS,8aS)-4-[2-(furan-3-yl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-1-oxo-2,3,5,6,7,8a-hexahydronaphthalen-2-yl]oxy]-4-[2-(furan-3-yl)ethyl]-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-2H-naphthalen-1-one molecular structure, CAS 170894-20-9](/structure-images/170894-20-9.png?v=struct-v3)
Product details
PubChem CID
15765316
Exact Mass
632.40769
InChIKey
JGQYOTZPAZMNBZ-LRVPTYLMSA-N
SMILES String
CC1=C(CCc2ccoc2)[C@@]2(C)CCCC(C)(C)[C@@H]2C(=O)[C@H]1O[C@H]1C(=O)[C@H]2C(C)(C)CCC[C@]2(C)[C@@](O)(CCc2ccoc2)[C@@H]1C
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
(2S,4aS,8aS)-2-[[(2R,3R,4R,4aS,8aS)-4-[2-(furan-3-yl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-1-oxo-2,3,5,6,7,8a-hexahydronaphthalen-2-yl]oxy]-4-[2-(furan-3-yl)ethyl]-3,4a,8,8-tetramethyl-5,6,7,8a-tetrahydro-2H-naphthalen-1-one is identified by CAS 170894-20-9, with molecular formula C40H56O6, molecular weight 632.9, InChIKey JGQYOTZPAZMNBZ-LRVPTYLMSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.
For laboratory research and professional procurement workflows.
Heavy atom count
46
H-bond acceptors
6
H-bond donors
1
Rotatable bonds
8
Ring count
6
Aromatic rings
2
Topological polar surface area
89.88 Ų
Computed LogP
8.71
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
No
Structure family
other structure rule
Precious metal motif
No
Transition metal motif
No
Phosphine ligand motif
No
N-heterocycle motif
No
Boronic acid motif
No
Computed structure descriptors generated from molecular structure. These are not experimental physical property values, supplier specifications, SDS data, or bioactivity claims.
Structural features
90 g/mol, PubChem CID 15765316.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
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Documentation needs
Review supplier documentation before handling; for research use only.
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