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Compounds

COMPOUND NPA007311

STRUCTURE

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PROPERTIES

NPAID	NPA007311
CLUSTER ID	3276
NODE ID	163
NAME	3-hydroxyl-(22E, 24R)-ergosta-5,8,22-trien-7,15-dione
FORMULA	C28H40O3
MOLECULAR WEIGHT (Da)	424.6250
ACCURATE MASS (Da)	424.2977
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Rhizopus
ORIGIN SPECIES	sp.
InChIKey	HSRKDEUTHACTMM-GTPSUKJLSA-N
InChI	InChI=1S/C28H40O3/c1-16(2)17(3)7-8-18(4)22-15-24(31)26-25-21(10-12-28(22,26)6)27(5)11-9-20(29)13-19(27)14-23(25)30/h7-8,14,16-18,20,22,26,29H,9-13,15H2,1-6H3/b8-7+/t17-,18+,20-,22+,26-,27-,28+/m0/s1
SMILES	C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC(=O)[C@@H]2[C@@]1(CCC3=C2C(=O)C=C4[C@@]3(CC[C@@H](C4)O)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Wang, Fazuo; Fang, Yuchun; Zhang, Min; Lin, Aiqun; Zhu, Tianjiao; Gu, Qianqun; Zhu, Weiming Six new ergosterols from the marine-derived fungus Rhizopus sp Steroids 2008 73 (1) 19.
DOI	10.1016/j.steroids.2007.08.008	PMID	17900642

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Phylum	Mucoromycota	MycoBank	1913637
Class	Mucoromycetes	MycoBank	2212703
Order	Mucorales	MycoBank	4827
Family	Mucoraceae	MycoBank	34489
Genus	Rhizopus	MycoBank	4842

CLASSYFIRE

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DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

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SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

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