CAS: 470-55-3
이름: (2S,3R,4S,5R,6R)-2-[[(2R,3R,4S,5R,6S)-6-[[(2R,3S,4S,5R,6R)-6-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
SMILES:
C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC3C(C(C(C(O3)OC4(C(C(C(O4)CO)O)O)CO)O)O)O)O)O)O)O)O)O)OMolecular Processing
Molecular formula
C24H42O21
Molecular weight
666.58
Exact mass
666.2219
XLogP
-9.75
TPSA
347.83
H-bond donors
14
H-bond acceptors
21
Rotatable bonds
11
Heavy atoms
45
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
19
Undefined stereo
19
Formal charge
0
Heteroatoms
21
Covalent units
1
Fraction Csp3
1
Molar refractivity
133.91
Supplementary Information
InChIKey: UQZIYBXSHAGNOE-XNSRJBNMSA-N
동의어
Stachyose470-55-3CHEBI:17164DTXSID30889345(2S,3R,4S,5R,6R)-2-(((2R,3R,4S,5R,6S)-6-(((2R,3S,4S,5R,6R)-6-(((2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl)oxy)-3,4,5-trihydroxyoxan-2-yl)methoxy)-3,4,5-trihydroxyoxan-2-yl)methoxy)-6-(hydroxymethyl)oxane-3,4,5-triol(2S,3R,4S,5R,6R)-2-{[(2R,3R,4S,5R,6S)-6-{[(2R,3S,4S,5R,6R)-6-{[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triolRefChem:9235GlyTouCan:G21073BEDTXCID601324144(2S,3R,4S,5R,6R)-2-(((2R,3R,4S,5R,6S)-6-(((2R,3S,4S,5R,6R)-6-((2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl)oxy-3,4,5-trihydroxyoxan-2-yl)methoxy)-3,4,5-trihydroxyoxan-2-yl)methoxy)-6-(hydroxymethyl)oxane-3,4,5-triolalpha-D-Glucopyranoside, beta-D-fructofuranosyl O-alpha-D-galactopyranosyl-(1->6)-O-alpha-D-galactopyranosyl-(1->6)-G21073BE207-427-3beta-D-fructofuranosyl O-alpha-D-galactopyranosyl-(1-6)-O-alpha-D-galactopyranosyl-(1-6)-alpha-D-galactopyranoside25VX64653ND-StachyoseLupeoseMFCD00006631(2R,3R,4S,5S,6R)-2-(((2S,3S,4S,5R)-3,4-Dihydroxy-2,5-bis(hydroxymethyl)tetrahydrofuran-2-yl)oxy)-6-((((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-((((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-3,4,5-triolManneotetroseb-D-Fructofuranosyl-O-a-D-galactopyranosyl-1-6-O-a-D-galactopyranosyl-1-6-a-D-glucopyranoside(2R,3R,4S,5S,6R)-2-{[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-6-({[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-({[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}methyl)oxane-3,4,5-triolStachyose - 70%bmse000240Epitope ID:150068Stachyose hydrate - 80%C01613SCHEMBL32922orb2664817orb3025079
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