(3S,4S,21R)-21-Carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid
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(3S,4S,21R)-21-Carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid
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CAS No:
72939-69-6
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Formula:
C34H34N4O5
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Chemical Name:
(3S,4S,21R)-21-Carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid
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Synonyms:
3-Phorbinepropanoic acid,21-carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-,(3S,4S,21R)-;3-Phorbinepropanoic acid,21-carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-,[3S-(3α,4β,21β)]-;(3S,4S,21R)-21-Carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid;Chlorophyllin;693207-79-3
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CAS No:
Description
13(2)-carboxypyropheophorbide a is a pheophorbide. It is a conjugate acid of a 13(2)-carboxypyropheophorbide a(2-).
(3S,4S,21R)-21-Carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid Basic Attributes
578.7 g/mol
578.66
277-114-4
(3S,4S,21R)-21-Carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoic acid Use and Manufacturing
3-Phorbinepropanoic acid, 21-carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-, (3S,4S,21R)-: INACTIVE
Computed Properties
Molecular Weight:578.7
XLogP3:2.4
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:6
Exact Mass:578.25292020
Monoisotopic Mass:578.25292020
Topological Polar Surface Area:144
Heavy Atom Count:43
Complexity:1800
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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