21-Episerratriol

CAS	24513-57-3
Structure
Synonyms	C(14a)-Homo-27-norgammacer-14(15)-ene-3β,21β,24-triol
IUPAC Name	(3S,6R,7S,8S,11R,12S,15S,16R,19R,21R)-7-(hydroxymethyl)-3,7,11,16,20,20-hexamethylpentacyclo[13.8.0.03,12.06,11.016,21]tricos-1(23)-ene-8,19-diol
Molecular Weight	458.71
Molecular Formula	C30H50O3
Canonical SMILES	C[C@@]12CC[C@@H]3[C@@]([C@H]1CC[C@H]4C(=CC[C@@H]5[C@@]4(CC[C@H](C5(C)C)O)C)C2)(CC[C@@H]([C@]3(C)CO)O)C
InChI	InChI=1S/C30H50O3/c1-26(2)21-9-7-19-17-27(3)14-11-23-29(5,16-13-25(33)30(23,6)18-31)22(27)10-8-20(19)28(21,4)15-12-24(26)32/h7,20-25,31-33H,8-18H2,1-6H3/t20-,21-,22-,23+,24+,25-,27-,28+,29+,30+/m0/s1
InChI Key	VYUNCIDAMBNEFU-CLLDTJQCSA-N
Boiling Point	566.1±50.0 °C
Purity	98%
Density	1.10±0.1 g/ml
Appearance	Solid