Basic information
- CAS
5594-30-9- Standard SMILES
C=CC1=C(C)C2=NC1=CC1=NC(=CC3=C(C)C4=C(O)C(C(=O)OC)C(=C5NC(=C2)C(C)C5CCC(=O)OC)C4=N3)C(CC)=C1C- InChIKey
HUXSMOZWPXDRTN-UHFFFAOYSA-N- Molecular formula
- C36H38N4O5
- Average molar mass
- 606.7 g/mol
- Monoisotopic mass
- 606.28422033
Names & identifiers
- Preferred name
- Methyl phaeophorbide
- IUPAC
- methyl 16-ethenyl-11-ethyl-4-hydroxy-22-(3-methoxy-3-oxopropyl)-12,17,21,26-tetramethyl-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,4,6,8(26),9,11,13(25),14,16,18(24),19-undecaene-3-carboxylate
- English name
- methyl [3S-(3alpha,4beta,21beta]-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-3-propionate
- Molecular formula
- C36H38N4O5
- Molecular weight
- 606.71
Names & synonyms
Methyl phaeophorbidemethyl 16-ethenyl-11-ethyl-4-hydroxy-22-(3-methoxy-3-oxopropyl)-12,17,21,26-tetramethyl-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,4,6,8(26),9,11,13(25),14,16,18(24),19-undecaene-3-carboxylatemethyl 16-ethenyl-11-ethyl-4-hydroxy-22-(3-methoxy-3-oxopropyl)-12,17,21,26-tetramethyl-7,23,24,25-tetrazahexacyclo(18.2.1.15,8.110,13.115,18.02,6)hexacosa-1,4,6,8(26),9,11,13(25),14,16,18(24),19-undecaene-3-carboxylateRefChem:10896265594-30-9methyl pheophorbide-aPhaeophorbid A, methyl esterMethylbacteriopheophorbideNSC407320MethylpheophorbideMethyl phaeophorbide Amethyl pheophorbide
Show more names
Methyl pheophorbide aMethylpheophorbide aMethylphaeophorbide aPHEOPHORBIDEAMETHYLESTERPhaeophorbide a methyl esterDemagnesia chloric acid -a methyl ester(3S)-9-Ethenyl-14-ethyl-21α-methoxycarbonyl-4α,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid methyl ester
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 1,830
Physicochemical properties
- Melting point
- 226 · 226-228 °C
- Boiling point
- 956.2 · 956.2±65.0 °C(Predicted)
- Density
- 1.244 · 1.244±0.06 g/cm3(Predicted)
- form
- Solid
- color
- Brown to black
Chemistry & industry
Applications
UsesMethyl pheophorbide a is a natural product, one of the chlorophyll-a derivatives[1][2].
Suppliers21 total
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
成都健腾生物技术有限公司028-85159085 18080455027 · [email protected]
武汉布林科技有限公司3456065315 13260619011 · [email protected]
上海凌凯科技股份有限公司58950110 13124863828 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
上海先辉医药科技有限公司13564796979; 13564796979 · [email protected]
湖北成海化工有限公司027-59220433 18327245847 · [email protected]
Standardpharm Co. Ltd.86-714-3992388 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
April Scientific Inc.+886-930201767 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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