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7,7-Azo-3-Alpha,12-Alpha-dihydroxycholanic Acid

Product Code

TRC-A935000-10MG

CAS Number

86992-52-1

Product Format

Neat

Matrix

-

Molecular Formula

C48 H78 N2 O8

Molecular Weight

811.14

Product Categories

Steroids and derivatives, TRC

Pack Size:

10 mg

In stock

Estimated dispatch

Dispatch within 10 - 14 days

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Product Information

CAS Number

86992-52-1

Molecular Formula

C48 H78 N2 O8

Molecular Weight

811.14

Accurate Mass

810.5758

Smiles

C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C(CC4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)N=NC5CC6C[C@H](O)CC[C@]6(C)[C@H]7C[C@H](O)[C@]8(C)[C@H](CC[C@H]8[C@H]57)[C@H](C)CCC(=O)O

InChI

InChI=1S/C48H78N2O8/c1-25(7-13-41(55)56)31-9-11-33-43-35(23-39(53)47(31,33)5)45(3)17-15-29(51)19-27(45)21-37(43)49-50-38-22-28-20-30(52)16-18-46(28,4)36-24-40(54)48(6)32(10-12-34(48)44(36)38)26(2)8-14-42(57)58/h25-40,43-44,51-54H,7-24H2,1-6H3,(H,55,56)(H,57,58)/b50-49+/t25-,26-,27?,28?,29-,30-,31-,32-,33+,34+,35+,36+,37?,38?,39+,40+,43+,44+,45+,46+,47-,48-/m1/s1

IUPAC

(4R)-4-[(3R,8R,9S,10S,12S,13R,14S,17R)-7-[(E)-[(3R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-4-carboxybutan-2-yl]-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-7-yl]diazenyl]-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid

Storage Temperature

2-8C Fridge/Coldroom

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Matrix

-

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