CAS 471-77-2 Neoabietic acid - Analytical Products / Alfa Chemistry

CAT	APS471772
CAS	471-77-2
Structure
Synonyms	CTCM 189,1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethylidene)-, [1R-(1α,4aβ,4bα,10aα)]-, Podocarp-8(14)-en-15-oic acid, 13-isopropylidene- (8CI), Neoabietic acid, NSC 5007, (1R,4aR,4bS,10aR)-1,2,3,4,4a,4b,5,6,7,9,10,10a-Dodecahydro-1,4a-dimethyl-7-(1-methylethylidene)-1-phenanthrenecarboxylic acid
IUPAC Name	(1R,4aR,4bS,10aR)-1,4a-dimethyl-7-propan-2-ylidene-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
Molecular Weight	302.45
Molecular Formula	C20H30O2
Canonical SMILES	CC(=C1CC[C@H]2C(=C1)CC[C@@H]3[C@]2(C)CCC[C@@]3(C)C(=O)O)C
InChI	InChI=1S/C20H30O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h12,16-17H,5-11H2,1-4H3,(H,21,22)/t16-,17+,19+,20+/m0/s1

Accurate Mass	302.2246
Format	Neat
Product Type	Native/Parent
Shipping	+20°C
Storage Conditions	+4°C
Subcategory	Additional organic reference materials