Research chemical
CAS Number: 2329726-95-4
![13-(3,5-Dihydroxy-4-(3-(4-hydroxyphenyl)propanoyl)phenoxy)-2,3,4,5,6,7,14,15-octahydroxy-11,11a,13,14,15,15a-hexahydrodibenzo[g,i]pyrano[3,2-b][1,5]dioxacycloundecine-9,17-dione molecular structure, CAS 2329726-95-4](/structure-images/2329726-95-4.png?v=struct-v3)
Product details
PubChem CID
177927939
Exact Mass
738.143214
InChIKey
RLEJPWBVZMBEOX-UHFFFAOYSA-N
IUPAC Name
13-[3,5-dihydroxy-4-[3-(4-hydroxyphenyl)propanoyl]phenoxy]-3,4,5,11,12,21,22,23-octahydroxy-9,14,17-trioxatetracyclo[17.4.0.02,7.010,15]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione
SMILES String
O=C1OCC2OC(Oc3cc(O)c(C(=O)CCc4ccc(O)cc4)c(O)c3)C(O)C(O)C2OC(=O)c2cc(O)c(O)c(O)c2-c2c1cc(O)c(O)c2O
Catalog navigation
Linked by recorded structural or research relationships, not interchangeable products. Check the exact CAS, specification and availability on the linked product page.
13-(3,5-Dihydroxy-4-(3-(4-hydroxyphenyl)propanoyl)phenoxy)-2,3,4,5,6,7,14,15-octahydroxy-11,11a,13,14,15,15a-hexahydrodibenzo[g,i]pyrano[3,2-b][1,5]dioxacycloundecine-9,17-dione is identified by CAS 2329726-95-4, with molecular formula C35H30O18, molecular weight 738.6, InChIKey RLEJPWBVZMBEOX-UHFFFAOYSA-N.
Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.
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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
53
H-bond acceptors
18
H-bond donors
11
Rotatable bonds
6
Ring count
6
Aromatic rings
4
Topological polar surface area
310.66 Ų
Computed LogP
1.74
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
60 g/mol, PubChem CID 177927939.
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.
Safety and handling reference content is available through documentation requests.
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