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Soyasapogenol E
[CAS# 6750-59-0]

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CAS#: 6750-59-0
Product: Soyasapogenol E
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Identification
Name Soyasapogenol E
Synonyms (4Ar,6Ar,6As,6Br,9S,10S,12Ar,14Br)-10-Hydroxy-2,2,4A,6A,6B,9,12A-Heptamethyl-9-Methylol-3,5,6,6A,7,8,8A,10,11,12,13,14B-Dodecahydro-1H-Picen-4-One; Olean-12-En-22-One, 3,23-Dihydroxy-, (3Beta,4Beta)-
Molecular Structure CAS#: 6750-59-0, Soyasapogenol E
Molecular Formula C30H48O3
Molecular Weight 456.71
CAS Registry Number 6750-59-0
SMILES [C@@]23([C@@H]([C@@]1(C([C@]([C@@H](O)CC1)(CO)C)CC2)C)CC=C4[C@]3(CC[C@@]5([C@@H]4CC(CC5=O)(C)C)C)C)C
InChI 1S/C30H48O3/c1-25(2)16-20-19-8-9-22-27(4)12-11-23(32)28(5,18-31)21(27)10-13-30(22,7)29(19,6)15-14-26(20,3)24(33)17-25/h8,20-23,31-32H,9-18H2,1-7H3/t20-,21?,22-,23+,26-,27+,28-,29-,30-/m1/s1
InChIKey FNRBOAGVUNHDIL-DSXFTMRLSA-N
Properties
Density 1.101g/cm3 (Cal.)
Boiling point 554.595°C at 760 mmHg (Cal.)
Flash point 303.267°C (Cal.)
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List of Reports Available for Soyasapogenol E
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