CAS No. 13463-98-4

Chemical Identifiers

Linear Formula	C₄₀H₅₈CaO₄
Pubchem CID	24765
MDL Number	N/A
EC No.	236-677-6
IUPAC Name	calcium; (1R,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylate
Beilstein/Reaxys No.	N/A
SMILES	CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)[O-])C.CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)[O-])C.[Ca+2]
InchI Identifier	InChI=1S/2C20H30O2.Ca/c21-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22;/h27,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22);/q;;+2/p-2/t2*16-,17+,19+,20+;/m00./s1
InchI Key	DWPDSISGRAWLLV-JHZYRPMRSA-L