Details of Natural Product (NP) | NPcVar

General Information of Natural Product (ID: NP1284)
Natural Product Name		Emodin
Synonyms		emodin; 518-82-1; Emodol; Frangula emodin; 1,3,8-trihydroxy-6-methylanthracene-9,10-dione; Schuttgelb; Rheum emodin; Archin; Frangulic acid; 3-Methyl-1,6,8-trihydroxyanthraquinone; Persian Berry Lake; 1,3,8-Trihydroxy-6-methylanthraquinone; 6-Methyl-1,3,8-trihydroxyanthraquinone; 9,10-Anthracenedione, 1,3,8-trihydroxy-6-methyl-; 1,3,8-Trihydroxy-6-methyl-9,10-anthraquinone; C.I. Natural Yellow 14; 1,3,8-Trihydroxy-6-methyl-9,10-anthracenedione; Alatinone; Rheum-emodin; 4,5,7-Trihydroxy-2-methylanthraquinone; Frangulinic acid; UNII-KA46RNI6HN; C.I. 75440; NSC 408120; NSC 622947; Emodin-d4; Anthraquinone, 1,3,8-trihydroxy-6-methyl-; NSC408120; KA46RNI6HN; CHEMBL289277; Anthraquinone, 6-methyl-1,3,8-trihydroxy-; CHEBI:42223; 1,3,8-Trihydroxy-6-methylanthra-9,10-quinone; MFCD00001207; NSC622947; 1,3,8-tri-hydroxy-6-methyl-anthra-quinone; DSSTox_CID_5231; DSSTox_RID_77709; 6-Methyl-1,3,8-trihydroxy-9,10-anthracenedione; DSSTox_GSID_25231; EMO; 9,10-Anthracenedione, 1,3,8-trihydroxy-6-methyl- (9CI); 1,8-Trihydroxy-6-methylanthraquinone; CAS-518-82-1; SMR000326798; CCRIS 3528; HSDB 7093; SR-01000075615; EINECS 208-258-8; BRN 1888141; Emdoin; Frangula-emodin; AI3-38286; 3bqc; Emodin,(S); Spectrum_001954; 1f0q; 3ed0; SpecPlus_000332; Spectrum2_000895; Spectrum3_000742; Spectrum4_001757; Spectrum5_000614; Lopac-E-7881; Emodin, analytical standard; NCIMech_000049; Lopac0_000552; BSPBio_002324; KBioGR_002234; KBioSS_002508; 1,3,8-trihydroxy-6-methyl-anthracene-9,10-dione; MLS000563068; MLS001066370; MLS004257392; MLS006011712; DivK1c_006428; SCHEMBL177689; SPBio_000710; MEGxp0_000460; DTXSID5025231; ACon1_001939; BDBM11318; KBio1_001372; KBio2_002500; KBio2_005068; KBio2_007636; KBio3_001544; Emodin - CAS 518-82-1; HMS2230K22; HMS3261P05; HMS3373B16; HMS3655H22; 1,3,8-trihydroxy-6-methyl-9,10-dihydroanthracene-9,10-dione; ACT03256; BCP18372; TNP00318; ZINC3824868; 9, 1,3,8-trihydroxy-6-methyl-; Tox21_202999; Tox21_303218; Tox21_500552; CCG-35263; LMPK13040008; s2295; STL581876; 3-Methyl-1,8-trihydroxyanthraquinone; 4,7-Trihydroxy-2-methylanthraquinone; AKOS003348641; AC-1004; CS-1412; DB07715; KS-5189; LP00552; MCULE-1083063386; NSC-408120; NSC-622947; SDCCGSBI-0050535.P004; Anthraquinone,3,8-trihydroxy-6-methyl-; SMP2_000211; NCGC00015420-01; NCGC00015420-02; NCGC00015420-03; NCGC00015420-04; NCGC00015420-05; NCGC00015420-06; NCGC00015420-07; NCGC00015420-08; NCGC00015420-09; NCGC00015420-22; NCGC00091540-01; NCGC00091540-02; NCGC00091540-03; NCGC00091540-04; NCGC00091540-05; NCGC00257090-01; NCGC00260544-01; NCGC00261237-01; 1,3,8-Trihydroxy-6-methyl-anthraquinone; HY-14393; M371; NCI60_003906; 6-methyl-1,3,8-tri-hydroxy-anthra-quinone; E0500; EU-0100552; FT-0606539; FT-0667846; N1854; SW219906-1; 1,8-Trihydroxy-6-methyl-9,10-anthraquinone; Emodin, from Frangula bark, >=90% (HPLC); E 7881; J10081; K00056; Emodin; 6-Methyl-1,3,8-trihydroxyanthraquinone; 1,3, 8-Trihydroxy-6-methyl-9,10-anthraquinone; 1,3,8-Trihydroxy-6-methylanthra-9,10-quinone #; 518E821; A828825; Anthraquinone, 1,3,8-trihydroxy-6-methyl- (8CI); Q-100581; Q4348178; SR-01000075615-1; SR-01000075615-6; BRD-K58685305-001-03-0; 1,3,8-Trihydroxy-6-methyl-9,10-anthracenedione, 9CI; Emodin, United States Pharmacopeia (USP) Reference Standard; 1,3,8-trihydroxy-6-methyl-anthracene-9,10-dione;3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE Click to Show/Hide
Formula		C₁₅H₁₀O₅
Weight		270.24
Structure
Structure		3D Structure Download			2D Structure Download
InChI		InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3
InChI Key		RHMXXJGYXNZAPX-UHFFFAOYSA-N
Isomeric SMILES		CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)O
Canonical SMILES		CC1=CC2=C(C(=C1)O)C(=O)C3=C(C2=O)C=C(C=C3O)O
External Links		PubChem ID		3220
		CAS ID		518-82-1
		NPASS ID		NPC254847
		HIT ID		C0041
		CHEMBL ID		CHEMBL289277
NP Activity Charts		Click to show/hide
Activity Info

The Content Variation of Natural Product Induced by Different Factor(s)
*Species Name: Alternaria* sp. isolate MT6**
					Factor Name: PDB medium																																																																[1]
Species Info Factor Info
Experiment Detail																						Isolation of endophytes from Hypericum perforatum: Plant specimens of Hypericum perforatum were sampled at the Botanical garden of University of Szeged (N46.235, E20.159) in autumn. The leaf, stem, root and flower parts were separated, and these parts were examined for their fungal endophyte content. The plant materials were rinsed in running tap water to remove dust and debris and the specimens were cut into small segments of about 0.5 to 1 cm in length using a sterile blade. The plant segments were surface sterilized to kill the epiphytic microorganisms by sequentially immersing the plant material in 70% ethanol for 60 s, washing with sterile distilled water and then, steeping in 0.01% mercuric chloride (VWR) for 30 sec. Finally, the specimens were washed again with sterile distilled water 2-3 times and then allowed to dry on a sterile blotting paper. Each segment was placed onto the surface of potato dextrose agar (PDA; VWR) medium supplemented with ampicillin (50 mcg/mL) in a Petri dish. All plates were incubated at 25 ℃ for 5-10 days and were checked daily for the growth of fungal colonies. Pure isolates were obtained by picking up individual colonies from the plates and transferring them onto a fresh PDA medium where they were incubated at 25 ℃ for 10 days. Isolated endophytic fungi were cultured for 7 days at 25 ℃ in 50 ml PDB medium. Click to Show/Hide
Factor																																								Part										Location																				NP Content
PDB medium (25℃ + 7 days)																																								Leaves										Szeged, Hungary																				NP Content: 19.9 ng/mg
*Species Name: Alternaria* sp. isolate MT7**
					Factor Name: PDB medium																																																																[1]
Species Info Factor Info
Experiment Detail																						Isolation of endophytes from Hypericum perforatum: Plant specimens of Hypericum perforatum were sampled at the Botanical garden of University of Szeged (N46.235, E20.159) in autumn. The leaf, stem, root and flower parts were separated, and these parts were examined for their fungal endophyte content. The plant materials were rinsed in running tap water to remove dust and debris and the specimens were cut into small segments of about 0.5 to 1 cm in length using a sterile blade. The plant segments were surface sterilized to kill the epiphytic microorganisms by sequentially immersing the plant material in 70% ethanol for 60 s, washing with sterile distilled water and then, steeping in 0.01% mercuric chloride (VWR) for 30 sec. Finally, the specimens were washed again with sterile distilled water 2-3 times and then allowed to dry on a sterile blotting paper. Each segment was placed onto the surface of potato dextrose agar (PDA; VWR) medium supplemented with ampicillin (50 mcg/mL) in a Petri dish. All plates were incubated at 25 ℃ for 5-10 days and were checked daily for the growth of fungal colonies. Pure isolates were obtained by picking up individual colonies from the plates and transferring them onto a fresh PDA medium where they were incubated at 25 ℃ for 10 days. Isolated endophytic fungi were cultured for 7 days at 25 ℃ in 50 ml PDB medium. Click to Show/Hide
Factor																																								Part										Location																				NP Content
PDB medium (25℃ + 7 days)																																								Leaves										Szeged, Hungary																				NP Content: 20.8 ng/mg
*Species Name: Epicoccum nigrum* isolate MT1**
					Factor Name: PDB medium																																																																[1]
Species Info Factor Info
Experiment Detail																						Isolation of endophytes from Hypericum perforatum: Plant specimens of Hypericum perforatum were sampled at the Botanical garden of University of Szeged (N46.235, E20.159) in autumn. The leaf, stem, root and flower parts were separated, and these parts were examined for their fungal endophyte content. The plant materials were rinsed in running tap water to remove dust and debris and the specimens were cut into small segments of about 0.5 to 1 cm in length using a sterile blade. The plant segments were surface sterilized to kill the epiphytic microorganisms by sequentially immersing the plant material in 70% ethanol for 60 s, washing with sterile distilled water and then, steeping in 0.01% mercuric chloride (VWR) for 30 sec. Finally, the specimens were washed again with sterile distilled water 2-3 times and then allowed to dry on a sterile blotting paper. Each segment was placed onto the surface of potato dextrose agar (PDA; VWR) medium supplemented with ampicillin (50 mcg/mL) in a Petri dish. All plates were incubated at 25 ℃ for 5-10 days and were checked daily for the growth of fungal colonies. Pure isolates were obtained by picking up individual colonies from the plates and transferring them onto a fresh PDA medium where they were incubated at 25 ℃ for 10 days. Isolated endophytic fungi were cultured for 7 days at 25 ℃ in 50 ml PDB medium. Click to Show/Hide
Factor																																								Part										Location																				NP Content
PDB medium (25℃ + 7 days)																																								Flowers										Szeged, Hungary																				NP Content: 427.9 ng/mg

References
1	Host metabolite producing endophytic fungi isolated from Hypericum perforatum

If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Tao and Dr. Zhang.