(1'R,2R,2'S,4'S,5R,7'S,8'R,9'S,12'S,13'S,16'S,18'S)-16'-{[(2R,3R,4R,5R,6R)-3,4-dihydroxy-5-{[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-6-(hydroxymethyl)oxan-2-yl]oxy}-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-10'-one | C50H80O23 | MFCD31560814 | C[C@H]1[C@H]2[C@H](C[C@H]3[C@@H]4CC[C@H]5C[C@H](CC[C@]5(C)[C@H]4CC(=O)[C@]23C)O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[C@@H]4OC[C@@H](O)[C@H](O)[C@H]4O)[C@H]3O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)O[C@]11CC[C@@H](C)CO1 | 43505, 43505-0.1G, 43505-0.5G, BD00940217, CSC161190091, HY-N5074, M23807, T2S0886, V155810 | Chemspace

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Home CSCS00161190091

Structure Info

Chemspace ID: CSCS00161190091 (Synthesis)

MFCD: MFCD31560814

IUPAC Name: (1'R,2R,2'S,4'S,5R,7'S,8'R,9'S,12'S,13'S,16'S,18'S)-16'-{[(2R,3R,4R,5R,6R)-3,4-dihydroxy-5-{[(2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-6-(hydroxymethyl)oxan-2-yl]oxy}-5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-10'-one

Mol formula: C₅₀H₈₀O₂₃

Mol weight: 1049 Da

Catalog Number(s): 43505, 43505-0.1G, 43505-0.5G, BD00940217, CSC161190091, HY-N5074, M23807, T2S0886, V155810

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SMILES
INCHI
INCHI key
MOL

Properties
SDS

Properties

LogP: -1.79

Heavy atoms count: 73

Rotatable bond count: 11

Number of rings: 10

Carbon bond saturation, Fsp3: 0.98

Polar surface area (Å): 352

Hydrogen bond acceptors count: 23

Hydrogen bond donors count: 12

: Zoom the structure; CSCS00161190091

Items Overall 9 items from 4 suppliers

Supplier	Lead time	Ships from	Purity	Pack	Price, $	Qty
BLD Pharmatech Co., Limited	30 days	United States To:	98	5 mg	72	Go to cart Enquire
BLD Pharmatech Co., Limited	30 days	United States To:	98	10 mg	115	Go to cart Enquire
Description: Name:(2aS,4S,5'R,6aS,6bS,8aS,8bR,9S,10R,11aS,12aS,12bR)-4-(((2R,3R,4R,5R,6R)-3,4-Dihydroxy-5-(((2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4-(((2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5',6a,8a,9-tetramethylicosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]-8(2H)-one; Hazard statement: 6.1; CAS: 179464-23-4
BLD Pharmatech GmbH	30 days	Germany To:	98	5 mg	72	Go to cart Enquire
BLD Pharmatech GmbH	30 days	Germany To:	98	10 mg	115	Go to cart Enquire
Description: Name:(2aS,4S,5'R,6aS,6bS,8aS,8bR,9S,10R,11aS,12aS,12bR)-4-(((2R,3R,4R,5R,6R)-3,4-Dihydroxy-5-(((2S,3R,4S,5R,6R)-5-hydroxy-6-(hydroxymethyl)-3-(((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4-(((2S,3R,4S,5R)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-5',6a,8a,9-tetramethylicosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]-8(2H)-one; Hazard statement: 6.1; CAS: 179464-23-4
Astatech CN	40 days	China To:	98	100 mg	1,297	Go to cart Enquire
Astatech CN	40 days	China To:	98	500 mg	3,892	Go to cart Enquire
Description: TERRESTROSIN D; CAS: 179464-23-4
Molnova Chemicals	TBD	United States To:	98	5 mg	107	Go to cart Enquire
Molnova Chemicals	TBD	United States To:	98	10 mg	158	Go to cart Enquire
Molnova Chemicals	TBD	United States To:	98	25 mg	263	Go to cart Enquire
Description: Terrestrosin D; CAS: 179464-23-4

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