A'-Neo-30-norgammacerane, 22-butyl-, (17alpha,22R)-

3-hexan-2-yl-5a,5b,8,8,11a,13b-hexamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysene

CAS: 67069-16-3

Molecular Formula	`C33H58`
Molecular Weight	454.8 g/mol
LogP	13.1
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	0
Rotatable Bonds	4
Exact Mass	454.45386
Heavy Atoms	33
Complexity	734.0

Chemical Identifiers

CAS Number	67069-16-3
SMILES	`CCCCC(C)C1CCC2(C1CCC3(C2CCC4C3(CCC5C4(CCCC5(C)C)C)C)C)C`
InChIKey	`KTWXNNDHFXEEFL-UHFFFAOYSA-N`

📖 Product Overview

A'-Neo-30-norgammacerane, 22-butyl-, (17alpha,22R)- (CAS: 67069-16-3) is a chemical compound with molecular formula C33H58 and molecular weight 454.8 g/mol. Its IUPAC systematic name is 3-hexan-2-yl-5a,5b,8,8,11a,13b-hexamethyl-1,2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a-hexadecahydrocyclopenta[a]chrysene. LogP 13.1 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 0 Rotatable Bonds 4 Exact Mass 454.45386 Heavy Atoms 33 Complexity 734.0 InChI Key: KTWXNNDHFXEEFL-UHFFFAOYSA-N. SMILES: CCCCC(C)C1CCC2(C1CCC3(C2CCC4C3(CCC5C4(CCCC5(C)C)C)C)C)C.

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