N,O-Diacetyljervine

(4'-acetyl-3',6',10,11b-tetramethyl-11-oxospiro[1,2,3,4,6,6a,6b,7,8,11a-decahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-3-yl) acetate

Also Known As: N,O-Diacetyljervine|Jervine, acetate|NCI60_003854|(4'-acetyl-3',6',10,11b-tetramethyl-11-oxospiro[1,2,3,4,6,6a,6b,7,8,11a-decahydrobenzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-3-yl) acetate|28-Acetyl-11-oxo-17,23-epoxyveratraman-3-yl acetate|Veratraman-11-one,23-epoxy-, (3.beta.,23.beta.)-|(4'-acetyl-3',6',10,11b-tetramethyl-11-oxospiro[1,2,3,4,6,6a,6b,7,8,11a-decahydrobenzo[i]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[4,5-b]pyridine]-3-yl) acetate

Molecular Formula	C31H43NO5
Molecular Weight	509.31412 g/mol
LogP	3.4
Topological Polar Surface Area	72.9 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	509.31412
Monoisotopic Mass	509.31412
Heavy Atoms	37
Complexity	1110.0

Chemical Identifiers

CAS Number	7622-06-2
SMILES	CC1CC2C(C(C3(O2)CCC4C5CC=C6CC(CCC6(C5C(=O)C4=C3C)C)OC(=O)C)C)N(C1)C(=O)C
InChIKey	AETQSOZEKYWGIJ-UHFFFAOYSA-N