(2R,3S,3aR,4aS,4bS,6aR,7S,7dR,8S,9aR,14bS,14cR,16aS)-3,3a,6a,8,9,9a,10,11,14,14b,14c,15,16,16a-Tetradecahydro-14b,14c,17,17-tetramethyl-10-methylene-2-(1-methylethenyl)-7,8-(Epoxymethano)-2H,6H-cyclobuta(5,6)benz(1,2-e)oxireno(4',4'a)-1-benzopyrano(5',6':6,7)indeno(1,2-b)indole-3,4b,7d(5H,7H)-triol
[CAS# 78213-66-8]

Identification

• Name: (2R,3S,3aR,4aS,4bS,6aR,7S,7dR,8S,9aR,14bS,14cR,16aS)-3,3a,6a,8,9,9a,10,11,14,14b,14c,15,16,16a-Tetradecahydro-14b,14c,17,17-tetramethyl-10-methylene-2-(1-methylethenyl)-7,8-(Epoxymethano)-2H,6H-cyclobuta(5,6)benz(1,2-e)oxireno(4',4'a)-1-benzopyrano(5',6':6,7)indeno(1,2-b)indole-3,4b,7d(5H,7H)-triol
• Molecular Formula: C₃₇H₄₅NO₆
• Molecular Weight: 599.77
• CAS Registry Number: 78213-66-8
• SMILES: [C@]17%10[C@@H]([C@@H](O)[C@H](O[C@H]1CC[C@@]8([C@]6(C2=C5C3=C([NH]2)C=CC9=C3[C@]4([C@H](C[C@@H]4C(O[C@H]5[C@@H]6CC[C@@]78O)(C)C)C(C9)=C)O)C)C)C(=C)C)O%10
• InChI: 1S/C37H45NO6/c1-16(2)28-27(39)31-37(44-31)23(42-28)11-12-33(6)34(7)19(10-13-35(33,37)40)29-25-24-21(38-30(25)34)9-8-18-14-17(3)20-15-22(32(4,5)43-29)36(20,41)26(18)24/h8-9,19-20,22-23,27-29,31,38-41H,1,3,10-15H2,2,4-7H3/t19-,20+,22+,23-,27-,28+,29-,31+,33+,34+,35-,36+,37-/m0/s1
• InChIKey: LTCFBVUSILPMGG-BRSLXYMHSA-N

Properties

• Density: 1.396g/cm³ (Cal.)