71433-23-3
(2'S,4a'R,4b'S,7'S,8a'R)-2',4b',7,8',8',10a'-六甲基-3',4',4a',4b',5',6',7',8',8a',9',10',10a'-十二氢-2'H,3H-螺[1-苯并呋喃-2,1'-菲]-4,5,7'-三醇
Name(2'S,4a'R,4b'S,7'S,8a'R)-2',4b',7,8',8',10a'-六甲基-3',4',4a',4b',5',6',7',8',8a',9',10',10a'-十二氢-2'H,3H-螺[1-苯并呋喃-2,1'-菲]-4,5,7'-三醇
1Identification
【Name】
(2'S,4a'R,4b'S,7'S,8a'R)-2',4b',7,8',8',10a'-六甲基-3',4',4a',4b',5',6',7',8',8a',9',10',10a'-十二氢-2'H,3H-螺[1-苯并呋喃-2,1'-菲]-4,5,7'-三醇
【CAS】
【MDL】
MFCD16659626
【中文同义词】
(2'S,4a'R,4b'S,7'S,8a'R)-2',4b',7,8',8',10a'-六甲基-3',4',4a',4b',5',6',7',8',8a',9',10',10a'-十二氢-2'H,3H-螺[1-苯并呋喃-2,1'-菲]-4,5,7'-三醇
【EnglishSynonyms】
【pro_formula】
C7 H10 N2 O2
【pro_molWeight】
154.168
【Inchi】
InChI=1S/C7H10N2O2/c1-4(2)6-3-5(7(8)10)9-11-6/h3-4H,1-2H3,(H2,8,10)
【InChIKey】
InChIKey=YUJDBNXKEJDCSZ-UHFFFAOYSA-N
【SMILES】
CC(C)c1cc(no1)C(=O)N
【MOL File】
(2'S,4a'R,4b'S,7'S,8….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:4
XLogP3:1.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
(2'S,4a'R,4b'S,7'S,8a'R)-2',4b',7,8',8',10a'-六甲基-3',4',4a',4b',5',6',7',8',8a',9',10',10a'-十二氢-2'H,3H-螺[1-苯并呋喃-2,1'-菲]-4,5,7'-三醇.cml