Research chemical
CAS Number: 1245946-62-6
![(Z)-6-[(7S,10S,12S,13R,14R)-12-acetyloxy-7-hydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxohept-5-enoic acid molecular structure, CAS 1245946-62-6](/structure-images/1245946-62-6.png?v=struct-v3)
Product details
For laboratory research and professional procurement workflows.
PubChem CID
170915247
Exact Mass
570.282883
InChIKey
DKZXEHHGZYVJLI-MHYLSDDISA-N
SMILES String
CC(=O)O[C@@H]1C(=O)C2=C([C@@H](O)CC3C(C)(C)C(=O)CC[C@]23C)[C@]2(C)C(=O)CC(/C(C)=C\C(=O)CC(C)C(=O)O)[C@@]12C
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.
(Z)-6-[(7S,10S,12S,13R,14R)-12-acetyloxy-7-hydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxohept-5-enoic acid is identified by CAS 1245946-62-6, with molecular formula C32H42O9, molecular weight 570.7, InChIKey DKZXEHHGZYVJLI-MHYLSDDISA-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.
Heavy atom count
41
H-bond acceptors
9
H-bond donors
2
Rotatable bonds
6
Ring count
4
Aromatic rings
0
Topological polar surface area
152.11 Ų
Computed LogP
3.8
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
70 g/mol, PubChem CID 170915247.
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.