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Pyrocincholic Acid Methyl Ester

CAS
107160-24-7
Catalog Number
ACM107160247
Category
Other Products
Molecular Weight
456.7
Molecular Formula
C30H48O3

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Specification

IUPAC Name
methyl (4aS,6aR,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6b,9,9,12a-hexamethyl-3,4,5,6,6a,7,8,8a,10,11,12,13,14,14b-tetradecahydro-1H-picene-4a-carboxylate
Canonical SMILES
CC1(CCC2(CCC3=C(C2C1)CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C(=O)OC)C
InChI
InChI=1S/C30H48O3/c1-26(2)16-17-30(25(32)33-7)15-10-20-19(21(30)18-26)8-9-23-28(20,5)13-11-22-27(3,4)24(31)12-14-29(22,23)6/h21-24,31H,8-18H2,1-7H3/t21-,22-,23-,24-,28-,29-,30+/m0/s1
InChI Key
HVJLCVYGDWRBEN-DVXVSMJQSA-N
Density
5mg 10mg 20 mg
Appearance
Powder
Physical Description
Powder
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