CAS 3615-39-2 D-Sorbose (HCID 107428)

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Basic information

CAS: 3615-39-2
Standard SMILES: O=C(CO)[C@H](O)[C@@H](O)[C@H](O)CO
InChIKey: BJHIKXHVCXFQLS-PYWDMBMJSA-N
Molecular formula: C6H12O6
Average molar mass: 180.16 g/mol
Monoisotopic mass: 180.0633881

Overview

Keto-D-sorbose is a D-sorbose. It is an enantiomer of a keto-L-sorbose.

Names & identifiers

Preferred name: D-Sorbose
IUPAC: (3R,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-one
English name: Sorbose
Molecular weight: 0

Names & synonyms

D-sorbose3615-56-3(3R,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-oneSorbose, D-keto-D-sorboseJJ09461NJSDTXSID101018679CHEBI:13022RefChem:794285GlyTouCan:G53074HTD-sorbose;D-xylo-hex-2-uloseCHEBI:17317

Show more names

DTXCID701476730G53074HT222-796-0D-(+)-SorboseMFCD00151095D-XYLO-2-HEXULOSE3615-39-2Sorbinose

Database identifiers

CAS: 3615-39-2、3615-56-3
PubChem CID: 107428
DTXSID: DTXSID101018679
ChEBI: CHEBI:13022
UNII: JJ09461NJS
EC Number: 222-796-0
Nikkaji: J94.872A

Properties

Computed structural properties

XLogP: -3.2
Topological polar surface area: 118 Å²
Hydrogen bond donors: 5
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 12
Formal charge: 0
Complexity: 147

Experimental & physicochemical properties

SpringerMaterials PropertiesCrystal structure

Physicochemical properties

FDA UNII: 2001607 Y · NV2001607Y

Chemistry & industry

Suppliers97 total

北京华美互利生物化工010-56205725 · [email protected]

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

湖南韵邦生物科技股份有限公司85561037 15386497078 · [email protected]

Related reactions

4 records

New reaction record

HRID 359649As reactantuspto-grants-1991_03

HRID 437259As reactantuspto-grants-1977_06

HRID 2119042As reactantuspto-grants-1987_07

HRID 2416388As reactantuspto-grants-2004_11

Compound notes

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