(4aS,6aR,6bR,8aR,10S,12aR,12bR,14bS)-6a-((((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)methyl)-10-hydroxy-2,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid

Catalog No. :: ACTUAL138
CAS No. :: 55497-79-5
Molecular Formula :: C39H54O7
Molecular Weight :: 634.85

IUPAC Name:(4aS,6aR,6bR,8aR,10S,12aR,12bR,14bS)-6a-((((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)methyl)-10-hydroxy-2,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid

(4aS,6aR,6bR,8aR,10S,12aR,12bR,14bS)-6a-((((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)methyl)-10-hydroxy-2,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid structure diagram

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Product Name	(4aS,6aR,6bR,8aR,10S,12aR,12bR,14bS)-6a-((((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)methyl)-10-hydroxy-2,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid
IUPAC Name	(4aS,6aR,6bR,8aR,10S,12aR,12bR,14bS)-6a-((((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)methyl)-10-hydroxy-2,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid
MDL No.	MFCD20274875
Molecular Formula	C39H54O7
Molecular Weight	634.85
SMILES	CC1(C)CC[C@]2(C(=O)O)CC[C@]3(COC(=O)/C=C/C4=CC(O)=C(O)C=C4)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
InChI Key	IZCSLJUDQLFLNO-YYGQYJBBSA-N
Synonym	Myriceric acid B;Wax fruit myric acid B;Olean-12-en-28-oic acid,27-[[(2E)-3-(3,4-dihydroxyphenyl)-1- oxo-2-propenyl]oxy]-3-hydroxy-,(3a)-;Olean-12-en-28-oic acid, 27-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-3-hydroxy-, (3β)-
CAS No.	55497-79-5

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(4aS,6aR,6bR,8aR,10S,12aR,12bR,14bS)-6a-((((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)methyl)-10-hydroxy-2,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid

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1. ACTUAL138 Molecular Building Block Synthetic Route

2. ACTUAL138 Molecular Building Block Synthetic Route

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(4aS,6aR,6bR,8aR,10S,12aR,12bR,14bS)-6a-((((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)methyl)-10-hydroxy-2,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid

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Uncarinic acid E

10-hydroxy-6a-(((3-(4-hydroxyphenyl)acryloyl)oxy)methyl)-1,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid

(4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid

(1R,2R,4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-hydroxy-2-((((E)-3-(4-hydroxyphenyl)acryloyl)oxy)methyl)-1,6a,6b,9,9,12a-hexamethyl-1,3,4,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-octadecahydropicene-4a(2H)-carboxylic acid

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