Summary

Molecular formula: C32H48O4
SMILES: O=C/C(=C/CC[C@H]([C@H]1C[C@@H]([C@@]2([C@]1(C)CC=C1C2=CC[C@@H]2[C@]1(C)CC[C@@H](C2(C)C)O)C)OC(=O)C)C)/C
InChI: InChI=1S/C32H48O4/c1-20(19-33)10-9-11-21(2)25-18-28(36-22(3)34)32(8)24-12-13-26-29(4,5)27(35)15-16-30(26,6)23(24)14-17-31(25,32)7/h10,12,14,19,21,25-28,35H,9,11,13,15-18H2,1-8H3/b20-10+/t21-,25-,26+,27+,28+,30-,31-,32-/m1/s1
InChIKey: WHBDKSMVRWZXTN-CAQVYMNZSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=C2C(=CCC3CCCCC23)C2CCCC2C1

Scaffold Graph/Node level:
C1CCC2C(C1)CCC1C3CCCC3CCC21

Scaffold Graph level:
C1CCC2C(C1)CCC1C3CCCC3CCC21

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Prenol lipids
Sub class: Triterpenoids

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Synonymous chemical names:
3β-hydroxy-15α-acetoxy-5α-lanosta-7,9(11),24-trien-26-al

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Chemical structure download