(2S)-2-[(3R,5R,9R,10R,13S,14S,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoic acid

Modify Date: 2025-09-21 18:19:53

(2S)-2-[(3R,5R,9R,10R,13S,14S,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoic acid structure	Common Name	(2S)-2-[(3R,5R,9R,10R,13S,14S,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoic acid
	CAS Number	82509-40-8	Molecular Weight	456.70000
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₃₀H₄₈O₃	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Use of (2S)-2-[(3R,5R,9R,10R,13S,14S,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoic acid

3α-Hydroxytirucalla-7,24-dien-21-oic acid is a tirucallane triterpene isolated from the oleoresin of Protium hebetatum Daly[1].

Name	(2S)-2-[(3R,5R,9R,10R,13S,14S,17S)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoic acid

Description	3α-Hydroxytirucalla-7,24-dien-21-oic acid is a tirucallane triterpene isolated from the oleoresin of Protium hebetatum Daly[1].
Related Catalog	Signaling Pathways >> Others >> Others Research Areas >> Neurological Disease
References	[1]. Delcio Dias Marques, et al. Triterpenes from Protium hebetatum resin. Nat Prod Commun. 2010 Aug;5(8):1181-2.

Molecular Formula	C₃₀H₄₈O₃
Molecular Weight	456.70000
Exact Mass	456.36000
PSA	57.53000
LogP	7.39970
InChIKey	CGPBVNAIDFBRJG-HVGLGGOPSA-N
SMILES	CC(C)=CCCC(C(=O)O)C1CCC2(C)C3=CCC4C(C)(C)C(O)CCC4(C)C3CCC12C

Precursor 0
DownStream 3
CAS#:483-87-4 1,7-dimethylphe... CAS#:20291-75-2 1,2,8-Trimethyl... CAS#:28282-25-9 Beta-Elemonic acid

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