(6S,8R,11R,12S,15S,16R)-N,7,7,12,16-pentamethyl-15-[(1R)-1-(propan-2-ylideneamino)ethyl]tetracyclo[9.7.0.03,8.012,16]octadeca-1(18),2-dien-6-amine
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(6S,8R,11R,12S,15S,16R)-N,7,7,12,16-pentamethyl-15-[(1R)-1-(propan-2-ylideneamino)ethyl]tetracyclo[9.7.0.03,8.012,16]octadeca-1(18),2-dien-6-amine
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CAS No:
6791-78-2
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Formula:
C28H46N2
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Chemical Name:
(6S,8R,11R,12S,15S,16R)-N,7,7,12,16-pentamethyl-15-[(1R)-1-(propan-2-ylideneamino)ethyl]tetracyclo[9.7.0.03,8.012,16]octadeca-1(18),2-dien-6-amine
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Synonyms:
NSC91723;Buxenine-G-isopropylideneimine;NSC-91723;6791-78-2
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CAS No:
(6S,8R,11R,12S,15S,16R)-N,7,7,12,16-pentamethyl-15-[(1R)-1-(propan-2-ylideneamino)ethyl]tetracyclo[9.7.0.03,8.012,16]octadeca-1(18),2-dien-6-amine Basic Attributes
410.7 g/mol
410.366099476 g/mol
91723
Computed Properties
Molecular Weight:410.7
XLogP3:5.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:410.366099476
Monoisotopic Mass:410.366099476
Topological Polar Surface Area:24.4
Heavy Atom Count:30
Complexity:768
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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