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Chemical structure of Isonanangenine B

GC48618

Isonanangenine B

Also known as [(5R,5aS,9R,9aR,9bS)-9,9b-dihydroxy-6,6,9a-trimethyl-3-oxo-1,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl] hexanoate

A drimane sesquiterpene lactone

ChemicalCAS1623153-14-9MW380.5FormulaC21H32O6
CAS number
1623153-14-9
Molecular weight
380.5
Formula
C21H32O6
InChIKey
WQPFOWNSHXWLAY-NFWXSOHESA-N
Catalogue number
GC48618
Brand
GLPBIO
Computed properties PubChem CID 155859153 · XLogP 2.8 · TPSA 93.1 Ų · H-bond donors 2
XLogP
2.8
TPSA
93.1 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
27

SMILES CCCCCC(=O)O[C@@H]1C=C2C(=O)OC[C@@]2([C@@]3([C@@H]1C(CC[C@H]3O)(C)C)C)O

Computed descriptors from PubChem (CID 155859153), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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