Prosapogenin CP6 10mg

CAT: 0628-A14611-10Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0628-A14611-10Size:10 mg

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CAS Number

72629-76-6

Chemical Information

Clematoside S

(3|A)-23-hydroxy-3-{[|A-d-ribopyranosyl-(1→3)-6-deoxy-|A-l-altropyranosyl-(1→2)-|A-l-arabinopyranosyl]oxy}olean-12-en-28-oic acid has been reported in Clematis grata with data available.

CAS Number	72629-76-6
PubChem CID	194458
IUPAC Name	(4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4S,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4R,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Molecular Formula	C46H74O16
Molecular Weight	883.1
XLogP	2.1
Topological Polar Surface Area	255
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	16
Rotatable Bond Count	8
Heavy Atom Count	62
Formal Charge	0
Complexity	1690

SMILES

C[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H](CO[C@H]2O[C@H]3CC[C@]4([C@H]([C@]3(C)CO)CC[C@@]5([C@@H]4CC=C6[C@]5(CC[C@@]7([C@H]6CC(CC7)(C)C)C(=O)O)C)C)C)O)O)O)O[C@H]8[C@@H]([C@@H]([C@@H](CO8)O)O)O)O

InChI

InChI=1S/C46H74O16/c1-22-30(50)35(61-37-33(53)31(51)25(48)19-57-37)34(54)38(59-22)62-36-32(52)26(49)20-58-39(36)60-29-11-12-42(4)27(43(29,5)21-47)10-13-45(7)28(42)9-8-23-24-18-41(2,3)14-16-46(24,40(55)56)17-15-44(23,45)6/h8,22,24-39,47-54H,9-21H2,1-7H3,(H,55,56)/t22-,24-,25+,26-,27+,28+,29-,30-,31+,32-,33+,34+,35-,36+,37-,38-,39-,42-,43-,44+,45+,46-/m0/s1

InChIKey

IAGSHEHQJJTLLR-MYLSNVMOSA-N

Chemical Structure

2D Structure

CAS: 72629-76-6

CID: 194458

Formula: C46H74O16

MW: 883.1

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	883.1
XLogP3	2.1
Hydrogen Bond Donor Count	9
Hydrogen Bond Acceptor Count	16
Rotatable Bond Count	8
Exact Mass	882.49768627
Monoisotopic Mass	882.49768627
Topological Polar Surface Area	255 Å²
Heavy Atom Count	62
Formal Charge	0
Complexity	1690
Isotope Atom Count	0
Defined Atom Stereocenter Count	22
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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T5S1252-01	Prosapogenin A
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TBW00855	Prosapogenin III
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BB20	BPC 10mg + TB 10mg
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BB20	BPC 10mg+TB 10mg
BB20	BPC 10mg+TB 10mg (Peptide)

Prosapogenin CP6 10mg

Chemical Information

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