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(Q104987570)
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English
[3,8,14,17-Tetrahydroxy-17-(1-hydroxyethyl)-10,13-dimethyl-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-12-yl] pyridine-3-carboxylate
group of stereoisomers with the chemical formula C₂₇H₃₇NO₇
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Statements
instance of
group of stereoisomers
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subclass of
pregnane steroid
1 reference
inferred from
pregnane steroid
pyridine alkaloids
1 reference
inferred from
pyridine alkaloids
mass
487.25700252399986
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₇H₃₇NO₇
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canonical SMILES
O=C(OC1CC2C(O)(CC=C3CC(O)CCC32C)C4(O)CCC(O)(C(O)C)C14C)C=5C=NC=CC5
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Identifiers
InChI
InChI=1S/C27H37NO7/c1-16(29)25(32)10-11-27(34)24(25,3)21(35-22(31)17-5-4-12-28-15-17)14-20-23(2)8-7-19(30)13-18(23)6-9-26(20,27)33/h4-6,12,15-16,19-21,29-30,32-34H,7-11,13-14H2,1-3H3
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InChIKey
DRPIMPNUZUSUTN-UHFFFAOYSA-N
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PubChem CID
162887731
1 reference
based on heuristic
inferred from InChIKey
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