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기본 정보
- CAS
119170-52-4- 표준 SMILES
COc1cc(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c2c(O)c3c(=O)oc(C)cc3cc2c1- InChIKey
GBGJNKYTLIUCMX-YUMVGKRXSA-N- 분자식
- C27H32O15
- 평균 분자량
- 596.538 g/mol
- 단동위원소 질량
- 596.17412032
이름 및 식별자
- 우선 이름
- Cassiaside C
- IUPAC
- 10-Hydroxy-7-methoxy-3-methyl-1-oxo-1H-naphtho[2,3-c]pyran-9-yl 6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside
- 영어명
- Cassiaside C
- 분자식
- C27H32O15
- 분자량
- 596.54
이름 및 동의어
Cassiaside Ctoralactone-9-O-β-D-gentiobiosideToralactone 9-O-beta-D-gentiobiosideRivaroxaban Impurity 18 Hydrochloride9-[(6-O-β-D-Glucopyranosyl-β-D-glucopyranosyl)oxy]-10-hydroxy-3-methyl-1H-naphtho[2,3-c]pyran-1-one9-[(6-O-β-D-Glucopyranosyl-β-D-glucopyranosyl)oxy]-10-hydroxy-3-methyl-1H-naphtho[2,3-c]pyran-1-one USP/EP/BP1H-Naphtho[2,3-c]pyran-1-one,9-[(6-O-b-D-glucopyranosyl-b-D-glucopyranosyl)oxy]-10-hydroxy-7-methoxy-3-methyl-1H-Naphtho[2,3-c]pyran-1-one, 9-[(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-10-hydroxy-7-methoxy-3-methyl-nephropathy,Diabetic,mesangial cell,end products,Endogenous Metabolite,Cassiae Semen,TGF-β1,Cassiaside C,Advanced glycation,Inhibitor,inhibit
데이터베이스 식별자
- CAS
119170-52-4- PubChem CID
- 5317701
- DTXSID
DTXSID201317838- ChEMBL
CHEMBL3634701- ChEBI
CHEBI:191460- Nikkaji
- J2.402.988C
물성
물리화학적 성질
- 녹는점
- 235 · 235-237 °C(Solv: methanol (67-56-1); water (7732-18-5))
- 끓는 점
- 932.2 · 932.2±65.0 °C(Predicted)
- 밀도
- 1.69 · 1.69±0.1 g/cm3(Predicted)
- 물리적 상태
- Solid
- 산도 계수 (pKa)
- 6.88 · 6.88±0.20(Predicted)
- 색상
- White to off-white
- InChIKey
- GBGJNKYTLIUCMX-XLXOWTOPNA-N
화학 및 산업
응용 분야
개요Cassiaside C belongs to the class of organic compounds known as naphthopyranone glycosides. Naphthopyranone glycosides are compounds containing a carbohydrate moiety glycosidically linked to a naphthopyranone moiety. Cassiaside C has been detected, but not quantified in, several different foods, such as arabica coffees (Coffea arabica), coffee and coffee products, herbs and spices, pulses, and robusta coffees (Coffea canephora). This could make cassiaside C a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Cassiaside C.
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상류 원료
공급사67 곳
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