Research chemical
CAS Number: 61252-49-1
![Methyl (R)-4-((3R,5R,7R,8R,9S,10S,13R,14S,17R)-3-((ethoxycarbonyl)oxy)-7-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[A]phenanthren-17-YL)pentanoate molecular structure, CAS 61252-49-1](/structure-images/61252-49-1.png?v=struct-v3)
Product details
PubChem CID
14410149
Exact Mass
478.329439
InChIKey
PVFTVSUIBOGJNP-OLZUBPPLSA-N
IUPAC Name
methyl (4R)-4-[(3R,5R,7R,8R,9S,10S,13R,14S,17R)-3-ethoxycarbonyloxy-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
SMILES String
CCOC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](C1)C[C@@H](O)[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)CCC(=O)OC)CC[C@@H]12
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
Methyl (R)-4-((3R,5R,7R,8R,9S,10S,13R,14S,17R)-3-((ethoxycarbonyl)oxy)-7-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[A]phenanthren-17-YL)pentanoate is identified by CAS 61252-49-1, with molecular formula C28H46O6, molecular weight 478.7, InChIKey PVFTVSUIBOGJNP-OLZUBPPLSA-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.
Availability, pack size, lead time, and pricing are confirmed through RFQ.
For laboratory research and professional procurement workflows.
No physical property values available.
Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.
Heavy atom count
34
H-bond acceptors
6
H-bond donors
1
Rotatable bonds
6
Ring count
4
Aromatic rings
0
Topological polar surface area
82.06 Ų
Computed LogP
5.75
Fragment-like structure rule
No
Lead-like structure rule
No
Drug-like structure rule
Yes
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
Methyl (R)-4-((3R,5R,7R,8R,9S,10S,13R,14S,17R)-3-((ethoxycarbonyl)oxy)-7-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[A]phenanthren-17-YL)pentanoate (CAS 61252-49-1) is maintained as a commercial cas reference with formula C28H46O6, molecular weight 478.
Sourcing context
Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.
Research use context
Use this page for CAS identity lookup, internal catalog search, and commercial discovery workflows; structure-derived tags include drug-like rule profile.
Documentation needs
Review supplier documentation before handling; for research use only.
Safety and handling reference content is available through documentation requests.
For supplier-issued SDS, request documentation before handling, storage, shipment, or procurement decisions.
Submit the CAS number, quantity, purity requirement, and destination country for sourcing review.