N2300

Description	Band gap: 1.68 eV
IUPAC Name	(3R,4S,4aS,6aR,6bS,8aR,12aR,14aS,14bR)-3-hydroxy-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
Molecular Weight	456.7g/mol
Molecular Formula	(C54H72N2O4S2)n
Canonical SMILES	CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C(=O)O)O)C)C)C2C1)C)C)C
InChI	InChI=1S/C30H48O3/c1-25(2)14-15-26(3)16-17-28(5)19(20(26)18-25)8-9-21-27(4)12-11-23(31)30(7,24(32)33)22(27)10-13-29(21,28)6/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22-,23+,26+,27+,28+,29+,30-/m0/s1
InChI Key	BZXULBWGROURAF-URUDUEEJSA-N
Storage	room temp
Form	solid
Orbital Energy	HOMO -5.58 eV
Quality Level	100