(16S,17S)-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8,10,12(20),13(18),14-nonaene-5,16,17-triol
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![(16S,17S)-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8,10,12(20),13(18),14-nonaene-5,16,17-triol structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/02e3dcac09de443798d358789ddaa067.png "(16S,17S)-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8,10,12(20),13(18),14-nonaene-5,16,17-triol")
(16S,17S)-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8,10,12(20),13(18),14-nonaene-5,16,17-triol
structure -
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CAS No:
114451-04-6
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Formula:
C20H14O3
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Chemical Name:
(16S,17S)-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8,10,12(20),13(18),14-nonaene-5,16,17-triol
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Synonyms:
9,10-dihydro-5,9,10-trihydroxybenzo(b)fluoranthene;DH-5,9,10-THBF;trans-9,10-dihydro-5,9,10-trihydroxyB(b)F;114451-04-6;DH-5,9,10-Thbf;DTXSID60921383;trans-9,10-Dihydro-5,9,10-trihydroxyB(b)F;9,10-Dihydro-5,9,10-trihydroxybenzo(b)fluoranthene;9,10-Dihydrobenzo[e]acephenanthrylene-5,9,10-triol;9,10-Dihydrobenzo[b]fluoranthene-5,9alpha,10beta-triol;trans-9,10-Dihydrobenz(e)acephenanthrylene-5,9,10-triol;5-Hydroxy-trans-9,10-dihydro-9,10-dihydroxybenzo(b)fluoranthene;Benz(e)acephenanthrylene-5,9,10-triol, 9,10-dihydro-, trans-
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CAS No:
(16S,17S)-pentacyclo[10.7.1.02,7.08,20.013,18]icosa-1(19),2(7),3,5,8,10,12(20),13(18),14-nonaene-5,16,17-triol Basic Attributes
302.3 g/mol
302.094294304 g/mol
Computed Properties
Molecular Weight:302.3
XLogP3:3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Exact Mass:302.094294304
Monoisotopic Mass:302.094294304
Topological Polar Surface Area:60.7
Heavy Atom Count:23
Complexity:503
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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