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Phytochemical Details

01. General Information

Name	Patchouli alcohol
PubChem CID	10955174
Molecular Weight	222.37g/mol
Synonyms	patchouli alcohol, patchoulol
Formula	C₁₅H₂₆O
SMILES	CC1CCC2(C(C3CCC2(C1C3)C)(C)C)O
InChI	1S/C15H26O/c1-10-5-8-15(16)13(2,3)11-6-7-14(15,4)12(10)9-11/h10-12,16H,5-9H2,1-4H3/t10-,11+,12-,14-,15+/m0/s1
InChIKey	GGHMUJBZYLPWFD-CUZKYEQNSA-N
CAS Number	5986-55-0
ChEMBL ID	CHEMBL4588682
ChEBI ID	CHEBI:7940
Structure		Download 2D MOL 3D MOL

02. Source Information of Phytochemical

(1) Pogostemon cablin Warm

Chineses Pinyin	GuangHuoXiang
Use Part	Aerial Parts
Habitat	GuangDong, HaiNan
Flavor	Pungent
Meridian Tropism	Spleen, Stomach, Lung
Species	>Kingdom: Viridiplantae 　-->Phylum: Streptophyta 　　-->Class: Equisetopsida 　　　-->Order: Lamiales 　　　　-->Family: Lamiaceae 　　　　　-->Genus: Pogostemon 　　　　　　-->Species: Pogostemon cablin

(2) Centipeda minima Warm

Chineses Pinyin	EBuShiCao
Use Part	Whole Grass
Habitat	JiangSu, ZheJiang, AnHui, GuangDong
Flavor	Pungent
Meridian Tropism	Lung, Liver
Species	>Kingdom: Viridiplantae 　-->Phylum: Streptophyta 　　-->Class: Equisetopsida 　　　-->Order: Asterales 　　　　-->Family: Asteraceae 　　　　　-->Genus: Centipeda 　　　　　　-->Species: Centipeda minima

(3) Perilla frutescens Warm

Chineses Pinyin	BaiSu
Habitat	JiangSu, ZheJiang, AnHui, FuJian, JiangXi, ShanDong, ShangHai, HeNan, HuNan, HuBei, GuangDong, GuangXi, HaiNan, SiChuan, GuiZhou, YunNan, XiZang, ChongQing
Flavor	Pungent
Meridian Tropism	Lung, Large intestine
Species	>Kingdom: Viridiplantae 　-->Phylum: Streptophyta 　　-->Class: Equisetopsida 　　　-->Order: Lamiales 　　　　-->Family: Lamiaceae 　　　　　-->Genus: Perilla 　　　　　　-->Species: Perilla frutescens

(4) Pogostemon cablin Warm

Chineses Pinyin	HuangHuoXiang
Use Part	Stem-leaf
Habitat	GuangDong, HaiNan
Flavor	Pungent
Meridian Tropism	Spleen; Stomach; Lung
Species	>Kingdom: Viridiplantae 　-->Phylum: Streptophyta 　　-->Class: Equisetopsida 　　　-->Order: Lamiales 　　　　-->Family: Lamiaceae 　　　　　-->Genus: Pogostemon 　　　　　　-->Species: Pogostemon cablin

03. Combinatorial Therapeutic Effect(s)

Synergistic Effect

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Drug(s) whose efficacy can be enhanced by this phytochemical

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Combination Pair ID: 253

Ref_1

Pair Name	Patchouli alcohol, Cisplatin
Partner Name	Cisplatin
Disease Info	[ICD-11: 2C30]	Melanoma		Investigative
Biological Phenomena	Induction-->Blockade of cell cycle in G0/G1 phase
Gene Regulation	Up-regulation	Expression	CDH1	hsa999
	Down-regulation	Expression	MMP2	hsa4313
	Down-regulation	Expression	MMP9	hsa4318
	Down-regulation	Phosphorylation	SMAD2	hsa4087
	Down-regulation	Expression	VIM	hsa7431
In Vitro Model	B16-F10	Mouse melanoma	Mus musculus (Mouse)	CVCL_0159
In Vivo Model	B16F10 cells (1×10⁶ cells in 100 μL PBS) were subcutaneously injected into the right hind flank of the mice.
Result	The effects of patchouli alcohol and combination with cisplatin on proliferation, apoptosis and migration in B16F10 melanoma cells

Combination Pair ID: 1033

Ref_2

Pair Name	Patchouli alcohol, Vincristine
Partner Name	Vincristine
Disease Info	[ICD-11: 2C25]	Lung cancer		Investigative
Biological Phenomena	Induction-->Blockade of cell cycle in G0/G1 phase
Gene Regulation	Down-regulation	Expression	ABCB1	hsa5243
	Down-regulation	Phosphorylation	AKT1	hsa207
	Up-regulation	Expression	BAX	hsa581
	Down-regulation	Expression	BCL2	hsa596
	Up-regulation	Expression	CASP3	hsa836
	Up-regulation	Expression	CASP9	hsa842
	Down-regulation	Expression	CCNE1	hsa898
	Down-regulation	Expression	CD44	hsa960
	Down-regulation	Expression	CDK2	hsa1017
	Up-regulation	Expression	CDKN1A	hsa1026
	Up-regulation	Phosphorylation	CHEK1	hsa1111
	Up-regulation	Phosphorylation	CHEK2	hsa11200
	Up-regulation	Phosphorylation	H2AX	hsa3014
	Down-regulation	Expression	PROM1	hsa8842
	Up-regulation	Expression	TP53	hsa7157
In Vitro Model	A-549	Lung adenocarcinoma	Homo sapiens (Human)	CVCL_0023
Result	Patchouli alcohol induces G0 /G1 cell cycle arrest and apoptosis in vincristine-resistant non-small cell lung cancer through ROS-mediated DNA damage

04. Reference

No.	Title	Href
1	The effects of patchouli alcohol and combination with cisplatin on proliferation, apoptosis and migration in B16F10 melanoma cells. J Cell Mol Med. 2023 May;27(10):1423-1435. doi: 10.1111/jcmm.17745.	`Click`
2	Patchouli alcohol induces G0 /G1 cell cycle arrest and apoptosis in vincristine-resistant non-small cell lung cancer through ROS-mediated DNA damage. Thorac Cancer. 2023 Jul;14(21):2007-2017. doi: 10.1111/1759-7714.14982.	`Click`