Products for Research Use Only
RegisterLogin

Tubeimoside II

CAT: 0957-S9433-1mgSize: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0957-S9433-1mgSize:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
115810-12-3
Synonyms
Tubeimoside B
Target
Immunology & Inflammation related
Applications
Immunology & Inflammation
Smiles
CC1C2C (C (C (O1) OC3C (C (COC3OC (=O) C45CCC (CC4C6=CCC7C (C6 (CC5O) C) (CCC8C7 (CC (C (C8 (C) CO) OC9C (C (C (C (O9) CO) O) O) OC1C (C (C (CO1) OC (=O) CC (CC (=O) O2) (C) O) O) O) O) C) C) (C) C) O) O) O) OC1C (C (C (CO1) O) O) O
Molecular Formula
C63H98O30
Additionnal Information
Tubeimoside II (Tubeimoside B), a natural triterpenoid saponin isolated from herb, show anti-inflammatory, antitumor, and antitumor-promoting effects.
Storage Conditions
3 years -20°C powder

Chemical Information

tubeimoside II

Tubeimoside II is a triterpenoid.

CAS Number115810-12-3
PubChem CID14037387
IUPAC Name7,8,18,28,29,35,51,55,56,58-decahydroxy-30,54-bis(hydroxymethyl)-13,18,37,41,48,48,53,54-octamethyl-57-(3,4,5-trihydroxyoxan-2-yl)oxy-3,5,10,12,15,21,24,26,31,33-decaoxadecacyclo[39.9.3.211,14.222,25.134,38.01,46.04,9.027,32.037,42.045,53]octapentacont-44-ene-2,16,20-trione
Molecular FormulaC63H98O30
Molecular Weight1335.4
XLogP-3
Topological Polar Surface Area465
Hydrogen Bond Donor Count15
Hydrogen Bond Acceptor Count30
Rotatable Bond Count4
Heavy Atom Count93
Formal Charge0
Complexity2740
SMILES
CC1C2C(C(C(O1)OC3C(C(COC3OC(=O)C45CCC(CC4C6=CCC7C(C6(CC5O)C)(CCC8C7(CC(C(C8(C)CO)OC9C(C(C(C(O9)CO)O)O)OC1C(C(C(CO1)OC(=O)CC(CC(=O)O2)(C)O)O)O)O)C)C)(C)C)O)O)O)OC1C(C(C(CO1)O)O)O
InChI
InChI=1S/C63H98O30/c1-25-46-47(89-51-43(77)38(72)29(67)21-82-51)45(79)53(85-25)91-48-39(73)30(68)22-83-54(48)93-56(80)63-14-13-57(2,3)15-27(63)26-9-10-34-59(5)16-28(66)50(60(6,24-65)33(59)11-12-61(34,7)62(26,8)17-35(63)69)92-55-49(42(76)40(74)31(20-64)87-55)90-52-44(78)41(75)32(23-84-52)86-36(70)18-58(4,81)19-37(71)88-46/h9,25,27-35,38-55,64-69,72-79,81H,10-24H2,1-8H3
InChIKey
GBWAAJJGXQJTTA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of tubeimoside II
CAS: 115810-12-3
CID: 14037387
Formula: C63H98O30
MW: 1335.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1335.4
XLogP3-3
Hydrogen Bond Donor Count15
Hydrogen Bond Acceptor Count30
Rotatable Bond Count4
Exact Mass1334.61429170
Monoisotopic Mass1334.61429170
Topological Polar Surface Area465 Ų
Heavy Atom Count93
Formal Charge0
Complexity2740
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count34
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
S3814-25mgTubeimoside I
S3814-10mgTubeimoside I
S3814-01Tubeimoside I
S9161-01Ziyuglycoside II
S9314-01Atractylenolide II
S6240-01Sudan II
S9314-1mgAtractylenolide II
S9316-1mgPolyphyllin II
S7176-100mgSKI II
S7176-10mM/1mLSKI II

Alternative Products

CatalogName
TRC-T897030-100MGTubeimoside A
OT08921-01Tubeimoside
301086Tubeimoside III
301085Tubeimoside II
AB1852Tubeimoside I

Popular Products