Name: Vitamin D3-D3
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HIT ID:HIT218701085
Cas No:
Common Name:Vitamin D3-D3
IUPAC:(1S,3Z)-3-{2-[(1R,3aS,4E,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-octahydro-1H-inden-4-ylidene](1-2H)ethylidene}-4-(2H2)methylidenecyclohexan-1-ol
IUPAC:(1S,3Z)-3-{2-[(1R,3aS,4E,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-octahydro-1H-inden-4-ylidene](1-2H)ethylidene}-4-(2H2)methylidenecyclohexan-1-ol
InChI key:QYSXJUFSXHHAJI-GLSUUORTSA-N

Molecular Formula:C27H44O
Molecular Weight:387.666
Hydrogen Bond Donor (HBD):
Hydrogen Bond Acceptor (HBA):
LogP:
SMILES:[H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C(\[2H])=C1\C[C@@H](O)CCC1=C([2H])[2H])[C@H](C)CCCC(C)C
SMILES:[H][C@@]1(CC[C@@]2([H])\C(CCC[C@]12C)=C\C(\[2H])=C1\C[C@@H](O)CCC1=C([2H])[2H])[C@H](C)CCCC(C)C

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