1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid

Inquiry
For Research Use Only.
Category
Terpenes
Cat.No.
NP6698
CAS
113558-03-5
Product Name
1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid
Structure
Structure
Size Price Stock Quantity
1 mg $519 In stock

Product Details

Description
1,2,3,19-Tetrahydroxy-12-ursen-28-oic acid isolated from the herbs of Agrimonia pilosa.
Synonyms
(1beta,2alpha,3beta)-1,2,3,19-Tetrahydroxyurs-12-en-28-oic acid
IUPAC Name
(1R,2R,4aS,6aS,6aS,6bR,12aR,14bS)-1,10,11,12-tetrahydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Molecular Weight
504.7
Molecular Formula
C30H48O6
Canonical SMILES
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(C(C(C(C5(C)C)O)O)O)C)C)C2C1(C)O)C)C(=O)O
InChI
InChI=1S/C30H48O6/c1-16-10-13-30(24(34)35)15-14-26(4)17(21(30)29(16,7)36)8-9-19-27(26,5)12-11-18-25(2,3)22(32)20(31)23(33)28(18,19)6/h8,16,18-23,31-33,36H,9-15H2,1-7H3,(H,34,35)/t16-,18?,19+,20?,21-,22?,23?,26-,27-,28+,29-,30+/m1/s1
InChIKey
VULLSLYDWNGNKZ-OYHHKQTFSA-N
Purity
98%
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