Phytic acid - 10mM in Water , CAS No.83-86-3

CAS: 83-86-3 Cat. No.: P580486 분자식: C₆H₁₈O₂₄P₆ 분자량: 660.04 Beilstein Registry Number: 2201952 EC 번호: 201-506-6

등급 & 순도 10mM in Water

Synonyms

Fytic acid|hexasodium-phytate|1D-myo-inositol hexakisphosphate|Dermofeel pa-3|myo-inositol hexakisphosphate|Acido fitico [INN-Spanish]|Hexakis(dihydrogen phosphate) myo-inositol|Phytin|D-myo-Inositol 1,2,3,4,5,6-hexakisphosphate|Inosithexaphosphorsaure|Alkalovert|myo-Inositol, hexakis(dihydrogen phosphate)|Phytine|FYTIC ACID [WHO-DD]|Phytic acid (dry powder)|diphosphoinositol tetrakisphosphate|(1R,2r,3S,4R,5s,6S)-cyclohexane-1,2,3,4,5,6-hexayl hexakis(dihydrogen phosphate)|Acide fytique|myo-Inositol, 1,2,3,4,5,6-hexakis(dihydrogen phosphate)|Alkovert|Acidum fyticum|PHYTIC ACID [INCI]|Exfoderm|inositolhexaphosphoric acid|Saure des phytins|FYTIC ACID [MART.]|Inositol 1,2,3,4,5,6-hexakisphosphate|Inositol hexaphosphoric acid|Acide fytique [INN-French]|D-myo-Inositol-1,2,3,4,5,6-hexaphosphate|Acidum fyticum [INN-Latin]|Acido fitico|inositol hexakisphosphate|Phytate|Saure des phytins [German]|Inosithexaphosphorsaeure|INOSITOL, HEXAKIS(DIHYDROGEN PHOSPHATE), myo-|PHYTIC ACID [MI]|rel-(1R,2r,3S,4R,5s,6S)-Cyclohexane-1,2,3,4,5,6-hexayl hexakis(dihydrogen phosphate)|IHP|Phyton|myo-Inosistol hexakisphosphate|IP6|IP-6|Phytic acid (potassium)|D-chiro inositol hexakisphosphate|Inositol hexakis(phosphate)|Inosithexaphosphorsaure [German]|Phytic acid|Phyticacid|myo-Inositol hexakis(phosphate)|myo-inositol hexakis(dihydrogen phosphate)|Fytic acid [INN]|Inositol hexaphosphate|myo-Inositol 1,2,3,4,5,6-hexakisphosphate|(2,3,4,5,6-pentaphosphonooxycyclohexyl) dihydrogen phosphate

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

개요

Phytic acid (Inositol hexaphosphate) is a phosphorus storage compound of seeds and cereal grains. Phytic acid is known as a food inhibitor, which has a strong ability to chelate multivalent metal ions, specially zinc, calcium, iron and as with protein residue. Phytic acid inhibits the enzymatic superoxide source xanthine oxidase (XO), and has antioxidative, neuroprotective, anti-inflammatory effects.

사양

동의어

Fytic acid | hexasodium-phytate | 1D-myo-inositol hexakisphosphate | Dermofeel pa-3 | myo-inositol hexakisphosphate | Acido fitico [INN-Spanish] | Hexakis(dihydrogen phosphate) myo-inositol | Phytin | D-myo-Inositol 1,2,3,4,5,6-hexakisphosphate | Inosithexaphosphorsaure | Alkalovert | myo-Inositol, hexakis(dihydrogen phosphate) | Phytine Show more

사양 및 순도

10mM in Water

보관 조건

Store at -80°C

배송

Dry ice packs + Cold packs

이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.

이름과 식별자

Pubchem Sid

528772258

정식 스마일

C1(C(C(C(C(C1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O

IUPAC Name

(2,3,4,5,6-pentaphosphonooxycyclohexyl) dihydrogen phosphate

InChIKey

IMQLKJBTEOYOSI-UHFFFAOYSA-N

INCHI

1S/C6H18O24P6/c7-31(8,9)25-1-2(26-32(10,11)12)4(28-34(16,17)18)6(30-36(22,23)24)5(29-35(19,20)21)3(1)27-33(13,14)15/h1-6H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24)

이성체 SMILES

C1(C(C(C(C(C1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O

RTECS

NM7525000

분자량

660.04

Beilstein

2201952

Reaxy-Rn

8603247

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8603247&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • 분류 Organooxygen compounds
      • Subclass Alcohols and polyols
        • Level5 Cyclic alcohols and derivatives
          • Level6 Cyclitols and derivatives
            • Level7 Inositol phosphates

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 분류: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Cyclic alcohols and derivatives - Cyclitols and derivatives
• Direct Parent: Inositol phosphates
• Alternative Parents: Monoalkyl phosphates Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Inositol phosphate - Monoalkyl phosphate - Alkyl phosphate - Phosphoric acid ester - Organic phosphoric acid derivative - Organic oxide - Hydrocarbon derivative - Aliphatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as inositol phosphates. These are compounds containing a phosphate group attached to an inositol (or cyclohexanehexol) moiety.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

화학 및 물리적 특성

• 감도: Heat sensitive
• 굴절률: 1.4
• 분자량: 660.040 g/mol
• XLogP3: -10.300
• Hydrogen Bond Donor Count: 12
• Hydrogen Bond Acceptor Count: 24
• Rotatable Bond Count: 12
• Exact Mass: 659.861 Da
• Monoisotopic Mass: 659.861 Da
• Topological Polar Surface Area: 401.000 Ų
• Heavy Atom Count: 36
• Formal Charge: 0
• Complexity: 818.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1