(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (4aR,5R,6aS,6bR,8aR,10S,12aR,12bR,14bS)-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate | C42H68O14 | MFCD21608448 | CC1(C)CC[C@@]2([C@H](O)C[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O | AA00AO2Y, AE97670, AG00AO5Q, AR00AOUQ, ArZ-UP481334, CFN91027, CSC159262528, E88622, HY-N7022, IGA51159, M23688, MS-31467, TN1600, Y3170770, ZX-CY003110 | Chemspace

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Home CSSB00159262528

Structure Info

Chemspace ID: CSSB00159262528 (In-Stock Building Blocks)

MFCD: MFCD21608448

IUPAC Name: (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (4aR,5R,6aS,6bR,8aR,10S,12aR,12bR,14bS)-5-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-10-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylate

Mol formula: C₄₂H₆₈O₁₄

Mol weight: 797 Da

Catalog Number(s): AA00AO2Y, AE97670, AG00AO5Q, AR00AOUQ, ArZ-UP481334, CFN91027, CSC159262528, E88622, HY-N7022, IGA51159, M23688, MS-31467, TN1600, Y3170770, ZX-CY003110

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SMILES
INCHI
INCHI key
MOL

Properties
SDS

Properties

LogP: 1.33

Heavy atoms count: 56

Rotatable bond count: 7

Number of rings: 7

Carbon bond saturation, Fsp3: 0.928

Polar surface area (Å): 236

Hydrogen bond acceptors count: 13

Hydrogen bond donors count: 9

: Zoom the structure; CSSB00159262528

Items Overall 7 items from 3 suppliers

Supplier	Lead time	Ships from	Purity	Pack	Price, €	Qty
Angene International Limited	10 days	China To:	98	5 mg	299	Go to cart Enquire
Description: Eclalbasaponin I; CAS: 158511-59-2
A2B Chem	12 days	United States To:	98	1 mg	90	Go to cart Enquire
A2B Chem	12 days	United States To:	98	5 mg	224	Go to cart Enquire
A2B Chem	12 days	United States To:	98	10 mg	359	Go to cart Enquire
Description: Eclalbasaponin I; CAS: 158511-59-2
AA BLOCKS	12 days	United States To:	95	1 mg	96	Go to cart Enquire
AA BLOCKS	12 days	United States To:	95	5 mg	239	Go to cart Enquire
AA BLOCKS	12 days	United States To:	95	10 mg	381	Go to cart Enquire
Description: ECLALBASAPONIN I; CAS: 158511-59-2

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