Menogaril
Also known as Menogarol, 7-Con-O-methylnogarol, 7-OMEN
Key facts
What buyers check first
- CAS number
- 71628-96-1
- Formula
- C28H31NO10
- Molar mass
- 541.55 g/mol
- Solubility
- H2O insoluble (<0.01) (mg/mL)
- HS code
- 293299
- Category
- Screening compounds
What is Menogaril?
Plain description, key identifiers and synonyms
Menogaril is a semisynthetic derivative of the anthracycline antineoplastic antibiotic nogalamycin. Menogaril intercalates into DNA and interacts with topoisomerase II, thereby inhibiting DNA replication and repair and RNA and protein synthesis. This agent is less cardiotoxic than doxorubicin. (NCI04)
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (1R,10R,12R,21R,22S,23R,24R)-23-(dimethylamino)-4,8,12,22,24-pentahydroxy-10-methoxy-1,12-dimethyl-20,25-dioxahexacyclo[19.3.1.02,19.05,18.07,16.09,14]pentacosa-2,4,7(16),8,14,18-hexaene-6,17-dione
- CAS number
- 71628-96-1 CAS number cross-checked
- Molecular formula
- C28H31NO10
- UNII
- 8JSV4O30HQ
- InChIKey
- LWYJUZBXGAFFLP-OCNCTQISSA-N
- InChI
- InChI=1S/C28H31NO10/c1-27(36)8-10-6-11-16(21(32)15(10)14(9-27)37-5)22(33)17-13(30)7-12-24(18(17)20(11)31)38-26-23(34)19(29(3)4)25(35)28(12,2)39-26/h6-7,14,19,23,25-26,30,32,34-36H,8-9H2,1-5H3/t14-,19+,23+,25-,26-,27-,28-/m1/s1
- Canonical SMILES
- COC1CC(C)(O)Cc2cc3c(c(O)c21)C(=O)c1c(O)cc2c(c1C3=O)OC1OC2(C)C(O)C(N(C)C)C1O
- Isomeric SMILES
- C[C@@]1(C[C@H](C2=C(C3=C(C=C2C1)C(=O)C4=C5C(=CC(=C4C3=O)O)[C@@]6([C@@H]([C@H]([C@@H]([C@H](O5)O6)O)N(C)C)O)C)O)OC)O
Synonyms
- Menogarol
- 7-Con-O-methylnogarol
- 7-OMEN
- Menogarilo
- Menogarilum
- 7(R)-O-Methylnogarol
- 7-o-Methylnogarol
- OMEN,7-
- TUT 7
- 7-con-O-methylnorgarol
- 7-(R)-O-methylnogarol
- Tomosar
- 7(R)-O-Methylnorgarol
- 7-Con-O-methylnogaril
- Menogaril (USAN/INN)
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
| Solubility | H2O insoluble (<0.01) (mg/mL)exp.Measured value |
|---|
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 541.55 g/molcalc.Computed value |
|---|---|
| Exact mass | 541.1948 Dacalc.Computed value |
| LogP (octanol/water) | 0.87calc.Computed value |
| Topological polar surface area | 166.2 Ųcalc.Computed value |
| Hydrogen bond donors | 5calc.Computed value |
| Hydrogen bond acceptors | 11calc.Computed value |
| Rotatable bonds | 2calc.Computed value |
| Heavy atoms | 39calc.Computed value |
| Rings | 6calc.Computed value |
| Aromatic rings | 2calc.Computed value |
| Fraction sp3 carbons | 0.5calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 7calc.Computed value |
| Lipinski rule of five | Fails (2 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
O=C1c2cc3c(cc2C(=O)c2c1ccc1c2OC2CCCC1O2)CCCC3
6 rings, 27 atoms.
11 other chemicals share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Menogaril suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
Post one free request and suppliers who make or trade Menogaril can send you quotes. Your contact details stay private until you accept a quote.
Menogaril price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Industries and functions
Pharmacological actions
- Antibiotics, Antineoplastic
Regulatory status
Inventories, regulations and trade controls that list this substance
No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Menogaril is traded under.
Heterocyclic compounds with oxygen hetero-atom(s) only, other
- China28.9%
- Switzerland * partner reported12.7%
- Germany7.8%
- United States49.7%
- China11.9%
- India * partner reported3.3%
* Partner reported figures, a lower bound.
The HS code shown for Menogaril is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Menogaril, based on the data on this page
What is Menogaril?
What is the CAS number of Menogaril?
What is the molecular formula and weight of Menogaril?
What is Menogaril used for?
Is Menogaril hazardous?
What is the HS code of Menogaril?
Where can I buy Menogaril?
What is the price of Menogaril?
Guides for buyers
Practical guides that help when you source, ship or handle Menogaril
- Guide, Chemical identityCAS registry numbers explainedWhat a CAS number identifies, how the check digit works, why one chemical can have several numbers and what a CAS number cannot tell you about a product.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
- Guide, Trade and logisticsHS codes for chemicals and why they matterHow the Harmonized System classifies chemicals, the chapters that matter, the rules for chemically defined compounds and mixtures, and practical steps to find the right code.Read
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