Summary

Molecular formula: C29H48O4
SMILES: CC[C@H](C(C)C)CC[C@@H]([C@@H]1C[C@H](C2=C3[C@](CC[C@@]12C)(O)[C@]1(C)CC[C@H](C[C@H]1CC3=O)O)O)C
InChI: InChI=1S/C29H48O4/c1-7-19(17(2)3)9-8-18(4)22-16-24(32)25-26-23(31)15-20-14-21(30)10-11-28(20,6)29(26,33)13-12-27(22,25)5/h17-22,24,30,32-33H,7-16H2,1-6H3/t18-,19?,20-,21+,22-,24+,27-,28+,29-/m0/s1
InChIKey: LRZBZOYEXVMHPC-MVUSBSOGSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1CC2CCCCC2C2CCC3CCCC3=C12

Scaffold Graph/Node level:
OC1CC2CCCCC2C2CCC3CCCC3C12

Scaffold Graph level:
CC1CC2CCCCC2C2CCC3CCCC3C12

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Chemical classification

Kingdom: Organic compounds
Super class: Lipids and lipid-like molecules
Class: Steroids and steroid derivatives
Sub class: Stigmastanes and derivatives

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Synonymous chemical names:
leiwansterol a

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External chemical identifiers:
CID_139583142; NPATLAS_NPA000209; CHEMSPIDER_78440688; ZINC_ZINC000255228247

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Chemical structure download