Pregn-5-en-21-one, 21- (4, 5-dihydro-4-methyl-3H-pyrrol-2-yl)-3-hydroxy-20-methyl-, [3.beta., 20S,21(R)]-

Modify Date: 2025-08-29 15:59:25

Pregn-5-en-21-one, 21- (4, 5-dihydro-4-methyl-3H-pyrrol-2-yl)-3-hydroxy-20-methyl-, [3.beta., 20S,21(R)]- structure	Common Name	Pregn-5-en-21-one, 21- (4, 5-dihydro-4-methyl-3H-pyrrol-2-yl)-3-hydroxy-20-methyl-, [3.beta., 20S,21(R)]-
	CAS Number	986-45-8	Molecular Weight	411.62000
	Density	1.24g/cm3	Boiling Point	540.6ºC at 760 mmHg
	Molecular Formula	C₂₇H₄₁NO₂	Melting Point	N/A
	MSDS	N/A	Flash Point	280.8ºC

Name	Tomatillidine
Synonym	More Synonyms

Density	1.24g/cm3
Boiling Point	540.6ºC at 760 mmHg
Molecular Formula	C₂₇H₄₁NO₂
Molecular Weight	411.62000
Flash Point	280.8ºC
Exact Mass	411.31400
PSA	49.66000
LogP	5.04790
Index of Refraction	1.64
InChIKey	HIBLNBRXFIYJIP-UHFFFAOYSA-N
SMILES	CC1CN=C(C(=O)C(C)C2CCC3C4CC=C5CC(O)CCC5(C)C4CCC23C)C1

Tomatillidin

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