Sarcandrolide D

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For Research Use Only.

Category

Sesquiterpene

Cat.No.

NP5652

CAS

1207185-03-2

Product Name

Sarcandrolide D

Structure

Product Details

Description

Sarcandrolide D is a natural sesquiterpenoid compound isolated from some plant.

Synonyms

2-Butenoic acid, 2-methyl-, [(1aR,1bS,2R,2aS,5cR,9aR,10S,10aS,11aR,11bS,11cS,12aS,12bS)-8-[(acetyloxy)methyl]-1,1a,1b,2,2a,4,7,9,9a,10,10a,11,11a,11b,11c,12,12a,12b-octadecahydro-1,2a,10,12a-tetrahydroxy-1b,5,11b-trimethyl-4,7-dioxobiscyclopropa[4',5']cyclopenta[1',2',3':1,10;2'',1'':7,8]phenanthro[...

IUPAC Name

[(2R,8R,9S,10S,12R,13S,14S,16S,17S,19R,20S,21R,22S)-5-(acetyloxymethyl)-9,16,21,22-tetrahydroxy-13,20,25-trimethyl-4,24-dioxo-3,23-dioxanonacyclo[14.10.1.02,6.02,14.08,13.010,12.017,19.020,27.022,26]heptacosa-1(27),5,25-trien-9-yl]methyl (E)-2-methylbut-2-enoate

Molecular Weight

678.72

Molecular Formula

C37H42O12

Canonical SMILES

CC=C(C)C(=O)OCC1(C2CC2C3(C1CC4=C(C(=O)OC45C3CC6(C7CC7C8(C6=C5C9=C(C(=O)OC9(C8O)O)C)C)O)COC(=O)C)C)O

InChI

InChI=1S/C37H42O12/c1-7-14(2)28(39)47-13-35(44)22-8-19(22)32(5)23(35)10-18-17(12-46-16(4)38)30(41)48-36(18)24(32)11-34(43)21-9-20(21)33(6)27(34)26(36)25-15(3)29(40)49-37(25,45)31(33)42/h7,19-24,31,42-45H,8-13H2,1-6H3/b14-7+/t19-,20-,21+,22+,23-,24+,31-,32+,33+,34+,35+,36+,37+/m1/s1

InChIKey

FYTGVSJFROTUKO-FFTXOPGASA-N

Purity

>96%

Density

1.5±0.1 g/cm3

Appearance

Powder

pKa

9.77±0.70(Predicted)

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